SCHEMBL2316309

SCHEMBL2316309

O=Cc1cccc(N=Nc2ccccc2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.52
▸ CYP2A6 P11509 1/20 0.52
▸ UNG P13051 1/20 0.47
▸ MAOA P21397 1/20 0.43
▸ MAOB P27338 1/20 0.43
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ MAPT P10636 3/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ POLB P06746 2/20 0.41
▸ GAA P10253 1/20 0.41
▸ THRB P10828 1/20 0.41
▸ PLCG1 P19174 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ TRPA1 O75762 2/20 0.41
▸ TRIM24 O15164 1/20 0.41
▸ TRIM33 Q9UPN9 1/20 0.41
▸ PKM P14618 1/20 0.40
▸ HTT P42858 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL9640411 0.85 ALDH1A1 (0.52) ALDH1A1CYP2A6UNGMAOAMAOB
SCHEMBL9640413 0.85 ALDH1A1 (0.52) ALDH1A1CYP2A6UNGMAOAMAOB
SCHEMBL24598983 0.81 NPC1 (0.61) ALDH1A1CYP2A6MAOAMAOBMEN1
SCHEMBL2301281 0.80 ALDH1A1 (0.59) ALDH1A1CYP2A6MEN1KMT2AMAPT
SCHEMBL7542217 0.80 ALDH1A1 (0.59) ALDH1A1CYP2A6MEN1KMT2AMAPT
SCHEMBL29952896 0.79 ALDH1A1 (0.47) ALDH1A1CYP2A6UNGMAOAMAOB
SCHEMBL14690443 0.78 NFE2L2 (0.54) ALDH1A1MAOAMAOBMEN1KMT2A
SCHEMBL14690442 0.78 NFE2L2 (0.54) ALDH1A1MAOAMAOBMEN1KMT2A
SCHEMBL14690444 0.78 NFE2L2 (0.54) ALDH1A1MAOAMAOBMEN1KMT2A
SCHEMBL878514 0.78 ALDH1A1 (0.50) ALDH1A1CYP2A6UNGMAOAMAOB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1176151-B1 Synthesis of polynucleotides using combined oxidation/deprotection chemistry AGILENT TECHNOLOGIES INC (US) 2014-08-20 — — EP disclosed
US-8309706-B2 Nucleosides; sodium/lithium/potassium peroxides as nucleophilic agents; solid phase synthesis AGILENT TECHNOLOGIES, INC. (US) 2012-11-13 — — US disclosed
US-20110189664-A1 DIAGNOSTICS IN A MONOPLEX/MULTIPLEX FORMAT UNIVERSITY OF WOLLONGONG 2011-08-04 — — US disclosed
US-20090286696-A1 Double-Stranded Olidonucleotides and Uses Therefor UNIVERSITY OF WOLLONGONG 2009-11-19 — — US disclosed
WO-2008148143-A1 DIAGNOSTICS IN A MONOPLEX/MULTIPLEX FORMAT UNIVERSITY OF WOLLONGONG (AU) 2008-12-11 — — WO disclosed
US-20080206851-A1 Methods and compositions for RNA synthesis AGILENT TECHNOLOGIES, INC. 2008-08-28 — — US disclosed
US-20080206850-A1 new phosphoramidite compositions, that have Silyl-containing carbonate or thiocarbonate or ether as 5'-hydroxyl protecting groups useful of the synthesis of DNA, and in particular for the synthesis of long sequences of DNA AGILENT TECHNOLOGIES, INC. 2008-08-28 — — US disclosed
US-20080076913-A1 Methods of synthesizing oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection DELLINGER DOUGLAS J 2008-03-27 — — US disclosed
US-7271258-B2 Methods of synthesizing oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection AGILENT TECHNOLOGIES, INC. (US) 2007-09-18 — — US disclosed
US-7135565-B2 Synthesis of polynucleotides using combined oxidation/deprotection chemistry AGILENT TECHNOLOGIES, INC. (US) 2006-11-14 — — US disclosed
US-7101986-B2 Methods of synthesizing oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection AGILENT TECHNOLOGIES, INC. (US) 2006-09-05 — — US disclosed
EP-1553102-A1 Synthesis of oligonucleotides Agilent Technologies, Inc. (US) 2005-07-13 — — EP disclosed
EP-0984021-B1 Synthesis of oligonucleotides AGILENT TECHNOLOGIES INC (US) 2005-04-27 — — EP disclosed
US-20040230052-A1 Methods of synthesizing oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection THE REGENTS OF THE UNIVERSITY OF COLORADO 2004-11-18 — — US disclosed
US-6630581-B2 Condensing the 3'-OH or 5'-OH group of a support-bound nucleoside or oligonucleotide with a monomeric nucleoside phosphoramidite having a carbonate-protected hydroxyl group; treating the intermediate provided with a deprotecting reagent AGILENT TECHNOLOGIES, INC. 2003-10-07 — — US disclosed
US-20020058802-A1 Synthesis of polynucleotides using combined oxidation/deprotection chemistry THE REGENTS OF THE UNIVERSITY OF COLORADO 2002-05-16 — — US disclosed
US-20020045221-A1 Solid phase synthesis of oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection THE REGENTS OF THE UNIVERSITY OF COLORADO 2002-04-18 — — US disclosed
EP-1176151-A1 Synthesis of polynucleotides using combined oxidation/deprotection chemistry Agilent Technologies, Inc. (a Delaware corporation) (US) 2002-01-30 — — EP disclosed
US-6222030-B1 CONDENSING HYDROXY GROUP OF BOUND OLIGONUCLEOTIDE OR NUCLEOSIDE WITH NUCLEOSIDE PHOSPHORAMIDITE HAVING CARBONATE-PROTECTED HYDROXYL GROUP, TREATING WITH DEPROTECTING AGENT ALSO OXIDIZES PHOSPHITE TRIESTER LINKAGE AGILENT TECHNOLOGIES, INC. 2001-04-24 — — US disclosed
EP-0984021-A2 Synthesis of oligonucleotides Hewlett-Packard Company (US) 2000-03-08 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020045221-A1 Solid phase synthesis of oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection POLL, RNGTT, DNTT ALDH1A1 2882/4885CYP2A6 3487/4885UNG 81/4885
US-20080206850-A1 new phosphoramidite compositions, that have Silyl-containing carbonate or thiocarbonate or ether as 5'-hydroxyl protecting groups useful of the synthesis of DNA, and in particular for the synthesis of long sequences of DNA MTAP, OGG1, TYMP ALDH1A1 4030/4885CYP2A6 1826/4885UNG 21/4885
US-20040230052-A1 Methods of synthesizing oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection POLL, DNTT, RNGTT ALDH1A1 2740/4885CYP2A6 4006/4885UNG 25/4885
US-20090286696-A1 Double-Stranded Olidonucleotides and Uses Therefor DNTT, ADAR, DUT ALDH1A1 1826/4885CYP2A6 4774/4885UNG 74/4885
US-20080206851-A1 Methods and compositions for RNA synthesis FBL, RNGTT, METTL3 ALDH1A1 3403/4885CYP2A6 1744/4885UNG 184/4885
US-20020058802-A1 Synthesis of polynucleotides using combined oxidation/deprotection chemistry RNGTT, NT5C3B, PNP ALDH1A1 3264/4885CYP2A6 2864/4885UNG 14/4885
US-20080076913-A1 Methods of synthesizing oligonucleotides using carbonate protecting groups and alpha-effect nucleophile deprotection POLL, DNTT, RNGTT ALDH1A1 2559/4885CYP2A6 3959/4885UNG 28/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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