SCHEMBL7531928

SCHEMBL7531928

CC(C)(C)[Si](Oc1cc2c(s1)CCNC2)(c1ccccc1)c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PNMT P11086 8/20 0.44
ITGB3 P05106 5/20 0.34
ITGA2B P08514 5/20 0.34
CD44 P16070 1/20 0.34
MAOB P27338 1/20 0.34
PARP1 P09874 1/20 0.33
PARP2 Q9UGN5 1/20 0.33
PDCD1 Q15116 1/20 0.33
CD274 Q9NZQ7 1/20 0.33
CYP3A4 P08684 1/20 0.33
TPSAB1 Q15661 1/20 0.32
TPSD1 Q9BZJ3 1/20 0.32
TPSG1 Q9NRR2 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
SCHEMBL7530391 0.86 PNMT (0.36) PNMTITGB3ITGA2BPARP1PARP2
SCHEMBL3053106 0.80 PNMT (0.50) PNMTITGB3ITGA2BPARP1PARP2
SCHEMBL13287392 0.74 PNMT (0.45) PNMTITGB3ITGA2BCD44MAOB
SCHEMBL7527801 0.73 PNMT (0.51) PNMTITGB3ITGA2BPARP1PARP2
SCHEMBL4397849 0.72 PNMT (0.61) PNMTITGB3ITGA2BCD44MAOB
Hydrochloric Acid SCHEMBL14141606 0.70 PNMT (0.52) PNMTITGB3ITGA2BPARP1PARP2
SCHEMBL22559434 0.69 CD274 (0.33) PNMTCD274
SCHEMBL1914059 0.69 PNMT (0.39) PNMTPARP1PARP2TPSAB1TPSD1
SCHEMBL1038858 0.69 PNMT (0.56) PNMTITGB3ITGA2BCD44MAOB
SCHEMBL7528962 0.69 KDM4E (0.53) CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0785205-B1 2-SILYLOXYTETRAHYDROTHIENOPYRIDINE, SALT THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES (JP) 2002-04-17 EP claimed
EP-0785205-A1 2-SILYLOXYTETRAHYDROTHIENOPYRIDINE, SALT THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 1997-07-23 EP claimed
EP-0785205-B1 2-SILYLOXYTETRAHYDROTHIENOPYRIDINE, SALT THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES (JP) 2002-04-17 EP disclosed
US-5874581-A CHEMICAL INTERMEDIATE OF AN ANTIPLATELET MEDICINE AND AN ELASTASE INHIBITOR; REACTING A HALOSILANE AND A 2-OXO-4,5,6,7 -TETRAHYDROTHIENO(3,2-C)PYRIDINE IN THE PRESENCE OF A TERTIARY AMINE UBE INDUSTRIES, LTD. (JP) 1999-02-23 US disclosed
EP-0785205-A1 2-SILYLOXYTETRAHYDROTHIENOPYRIDINE, SALT THEREOF, AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES, LTD. (JP) 1997-07-23 EP disclosed