SCHEMBL10017439

SCHEMBL10017439

Cc1ccnc(O[Si](C)(C)C)n1

nearest known ligand 0.37

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ EDNRB P24530 1/20 0.37
▸ EDNRA P25101 1/20 0.37
▸ RXRA P19793 5/20 0.35
▸ GRIN1 Q05586 5/20 0.35
▸ GRIN2B Q13224 5/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ ALOX5AP P20292 3/20 0.34
▸ FEN1 P39748 3/20 0.34
▸ ALOX15 P16050 2/20 0.33
▸ UHRF1 Q96T88 1/20 0.33
▸ RAB9A P51151 3/20 0.33
▸ NPC1 O15118 3/20 0.33
▸ SMN1; SMN2 Q16637 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ POLB P06746 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32

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
SCHEMBL1376899 0.78 NUDT1 (0.32) —
SCHEMBL30125106 0.77 — —
SCHEMBL1153496 0.77 — —
SCHEMBL19073173 0.77 NOS3 (0.31) —
SCHEMBL10048540 0.77 SCN9A (0.47) RXRAGRIN1GRIN2BKMT2AMEN1
SCHEMBL8958798 0.77 SCN9A (0.33) RXRAGRIN1GRIN2B
SCHEMBL7049033 0.76 — —
SCHEMBL8154440 0.74 MAPK8 (0.41) EDNRBEDNRARXRAGRIN1GRIN2B
SCHEMBL10385800 0.74 CYP1A2 (0.41) RXRAGRIN1GRIN2BALOX15SMN1; SMN2
SCHEMBL25097150 0.72 GAA (0.43) EDNRBEDNRARXRAGRIN1GRIN2B

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160348110-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS ALNYLAM PHARMACEUTICALS INC (US) 2016-12-01 — — US disclosed
US-9481705-B2 Modular radiochemistry synthesis system THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-11-01 — — US disclosed
US-9453043-B2 Nucleic acid chemical modifications ALNYLAM PHARMACEUTICALS, INC. (US) 2016-09-27 — — US disclosed
US-20160130295-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2016-05-12 — — US disclosed
US-9211520-B2 Modular radiochemistry synthesis system THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-12-15 — — US disclosed
US-20150329583-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM ENERGY, UNITED STATES DEPARTMENT OF 2015-11-19 — — US disclosed
US-20150210733-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS BANK OF AMERICA, N.A. 2015-07-30 — — US disclosed
US-8975389-B2 Nucleic acid chemical modifications ALNYLAM PHARMACEUTICALS, INC. (US) 2015-03-10 — — US disclosed
US-8951480-B2 Modular radiochemistry synthesis system THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2015-02-10 — — US disclosed
US-8877733-B2 1′-substituted pyrimidine N-nucleoside analogs for antiviral treatment GILEAD SCIENCES, INC. (US) 2014-11-04 — — US disclosed
US-8765933-B2 Asynthesis of β-nucleosides PHARMAESSENTIA CORP. (TW) 2014-07-01 — — US disclosed
US-20120263678-A1 1'-SUBSTITUTED PYRIMIDINE N-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT GILEAD SCIENCES, INC. (US) 2012-10-18 — — US disclosed
US-20120259106-A1 ASYNTHESIS OF B-NUCLEOSIDES PHARMAESSENTIA CORP. (TW) 2012-10-11 — — US disclosed
US-8193339-B2 Synthesis of β-nucleosides PHARMAESSENTIA CORP. (TW) 2012-06-05 — — US disclosed
US-20090124797-A1 NOVEL SYNTHESIS OF BETA-NUCLEOSIDES PHARMAESSENTIA CORPORATION (TW) 2009-05-14 — — US 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 (6 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-20150210733-A1 NUCLEIC ACID CHEMICAL MODIFICATIONS NSUN2, RNMT, NSUN3 EDNRB 1354/4885EDNRA 2063/4885RXRA 3187/4885
US-20120263678-A1 1'-SUBSTITUTED PYRIMIDINE N-NUCLEOSIDE ANALOGS FOR ANTIVIRAL TREATMENT PNP, NUDT1, TYMP EDNRB 2725/4885EDNRA 2538/4885RXRA 1898/4885
US-20160130295-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM RAD18, MVD, USP18 EDNRB 4079/4885EDNRA 3605/4885RXRA 3686/4885
US-20120259106-A1 ASYNTHESIS OF B-NUCLEOSIDES ATIC, DPYD, DUT EDNRB 1821/4885EDNRA 2487/4885RXRA 2098/4885
US-20150329583-A1 MODULAR RADIOCHEMISTRY SYNTHESIS SYSTEM RAD18, MVD, USP18 EDNRB 4079/4885EDNRA 3605/4885RXRA 3686/4885
US-20090124797-A1 NOVEL SYNTHESIS OF BETA-NUCLEOSIDES DUT, DCTD, UMPS EDNRB 3301/4885EDNRA 3533/4885RXRA 4360/4885

“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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