SCHEMBL3487811

SCHEMBL3487811

C=CCn1cnc2ncncc21

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.44
HDAC1 Q13547 1/20 0.44
LTA4H P09960 1/20 0.43
ADORA2B P29275 2/20 0.35
NPC1 O15118 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ADORA2A P29274 2/20 0.31
PDE4A P27815 1/20 0.31
PDE4B Q07343 1/20 0.31
PDE4C Q08493 1/20 0.31
PDE4D Q08499 1/20 0.31
CYP1A2 P05177 1/20 0.30
CYP3A4 P08684 1/20 0.30
CYP2C19 P33261 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30

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
SCHEMBL3671304 0.77 LTA4H (0.50) HDAC6HDAC1LTA4HADORA2APDE4A
SCHEMBL820304 0.77 HDAC6 (0.38) HDAC6HDAC1LTA4H
SCHEMBL48336 0.77 ADORA2A (0.47) HDAC6HDAC1LTA4HNPC1HPGD
SCHEMBL7109676 0.75 LTA4H (0.48) HDAC6HDAC1LTA4HADORA2APDE4A
SCHEMBL338773 0.75 HDAC6 (0.52) HDAC6HDAC1LTA4HADORA2B
SCHEMBL11066170 0.74 ADORA2A (0.50) HDAC6HDAC1LTA4HADORA2BNPC1
SCHEMBL1079073 0.72 FDPS (0.50) HDAC6HDAC1LTA4HADORA2BNPC1
SCHEMBL5635371 0.72 LTA4H (0.49) HDAC6HDAC1LTA4HADORA2BADORA2A
SCHEMBL13044929 0.72 HDAC6 (0.47) HDAC6HDAC1LTA4HNPC1RAB9A
SCHEMBL8875192 0.72 LTA4H (0.45) LTA4HADORA2BNPC1HPGDRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210163484-A1 METHOD FOR SYNTHESIZING DIVERSELY SUBSTITUTED PURINES UNIVERSITÉ GRENOBLE ALPES (FR) 2021-06-03 US disclosed
EP-3619211-A1 METHOD FOR SYNTHESIZING DIVERSELY SUBSTITUTED PURINES Université Grenoble Alpes (FR) 2020-03-11 EP disclosed
CN-110582496-A Methods for synthesizing variously substituted purines 格勒诺布尔-阿尔卑斯大学 2019-12-17 CN disclosed
WO-2018203099-A1 METHOD FOR SYNTHESIZING DIVERSELY SUBSTITUTED PURINES UNIVERSITE GRENOBLE ALPES (FR) 2018-11-08 WO disclosed
US-9572891-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2017-02-21 US disclosed
US-20150374841-A1 Oligonucleotide Conjugates GERON CORPORATION 2015-12-31 US disclosed
US-9072790-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2015-07-07 US disclosed
EP-1543021-B1 OLIGONUCLEOTIDE CONJUGATES GERON CORP (US) 2014-07-30 EP disclosed
US-20130253042-A1 Oligonucleotide Conjugates GERON CORPORATION (US) 2013-09-26 US disclosed
US-8501897-B2 Method for producing liquid-crystalline polyester SUMITOMO CHEMICAL CO., LTD. (JP) 2013-08-06 US disclosed
US-8492500-B2 Method for producing liquid-crystalline polyester SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-07-23 US disclosed
US-8440635-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2013-05-14 US disclosed
US-20130030142-A1 METHOD FOR PRODUCING LIQUID-CRYSTALLINE POLYESTER SUMITOMO CHEMICAL COMPANY, LIMITED 2013-01-31 US disclosed
US-20130030141-A1 METHOD FOR PRODUCING LIQUID-CRYSTALLINE POLYESTER SUMITOMO CHEMICAL COMPANY, LIMITED 2013-01-31 US disclosed
US-20100016416-A1 Oligonucleotide Conjugates GERON CORPORATION (US) 2010-01-21 US disclosed
US-7563618-B2 Oligonucleotide conjugates GERON CORPORATION (US) 2009-07-21 US disclosed
US-20060141523-A1 Integrated method for PCR cleanup and oligonucleotide removal APPLERA CORPORATION (US) 2006-06-29 US disclosed
US-20040009602-A1 DNA modifying molecules and methods of use thereof THE GOVERNMENT OF THE U.S.A. AS REPRESENTED BY THE SECRETARY OF THE DEPT. OF HEALTH & HUMAN SERVICES 2004-01-15 US disclosed
US-20030138814-A1 Comprises RNA and nucleobase/fluorophore for inhibition of human telomerase activity (inhibits growth of cancerous cells) GERON CORPORATION 2003-07-24 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 (5 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-20210163484-A1 METHOD FOR SYNTHESIZING DIVERSELY SUBSTITUTED PURINES PNP, UMPS, NUDT1 HDAC6 4462/4885HDAC1 4460/4885LTA4H 1690/4885
US-20150374841-A1 Oligonucleotide Conjugates TERT, RNGTT, TRDMT1 HDAC6 1179/4885HDAC1 1374/4885LTA4H 2859/4885
US-20130253042-A1 Oligonucleotide Conjugates TERT, RNGTT, TRDMT1 HDAC6 1179/4885HDAC1 1374/4885LTA4H 2859/4885
US-20030138814-A1 Comprises RNA and nucleobase/fluorophore for inhibition of human telomerase activity (inhibits growth of cancerous cells) TERT, RNGTT, DUT HDAC6 1082/4885HDAC1 807/4885LTA4H 3110/4885
US-20100016416-A1 Oligonucleotide Conjugates TERT, RNGTT, TRDMT1 HDAC6 1179/4885HDAC1 1374/4885LTA4H 2859/4885

“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.