SCHEMBL8641037

SCHEMBL8641037

COc1ccc(CC(C)(O)c2c(OC)csc2C)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 1/20 0.39
▸ CASR P41180 5/20 0.37
▸ KMT2A Q03164 3/20 0.36
▸ AOC3 Q16853 1/20 0.35
▸ TUBB4A P04350 1/20 0.35
▸ TUBB P07437 1/20 0.35
▸ TUBA3C P0DPH7 1/20 0.35
▸ TUBA1B P68363 1/20 0.35
▸ TUBA4A P68366 1/20 0.35
▸ TUBB4B P68371 1/20 0.35
▸ TUBB3 Q13509 1/20 0.35
▸ TUBB2A Q13885 1/20 0.35
▸ TUBB8 Q3ZCM7 1/20 0.35
▸ TUBA3E Q6PEY2 1/20 0.35
▸ TUBA1A Q71U36 1/20 0.35
▸ TUBA1C Q9BQE3 1/20 0.35
▸ TUBB6 Q9BUF5 1/20 0.35
▸ TUBB2B Q9BVA1 1/20 0.35
▸ TUBB1 Q9H4B7 1/20 0.35
▸ MEN1 O00255 1/20 0.34

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
SCHEMBL8640485 0.84 NR3C1 (0.36) NR3C1CASRKMT2ATUBB4ATUBB
SCHEMBL8641470 0.83 LTA4H (0.43) CASRKMT2ANPC1LMNAHTT
SCHEMBL8639151 0.82 ALDH1A1 (0.41) NR3C1CASRKMT2ATUBB4ATUBB
SCHEMBL8641306 0.75 ALDH1A1 (0.35) NR3C1ERN1
SCHEMBL7710668 0.72 AOC3 (0.57) KMT2AAOC3MEN1IDO1CALM1
SCHEMBL8639554 0.70 NR3C1 (0.40) NR3C1CASRKMT2AAOC3MEN1
SCHEMBL11132376 0.69 IDO1 (0.50) NR3C1CASRAOC3IDO1CALM1
SCHEMBL809115 0.69 IDO1 (0.50) NR3C1CASRAOC3IDO1CALM1
SCHEMBL21720091 0.69 LMNA (0.31) LMNA
SCHEMBL9137688 0.69 TUBB4A (0.50) AOC3TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0516257-B1 Phenylbenzo[b]furans and -thiophenes, procedures for their preparation, and pharmaceutical compositions containing the same SCHERING AG (DE) 1998-08-05 — — EP disclosed
US-5470854-A Antiestrogens SCHERING AKTIENGESELLSCHAFT (DE) 1995-11-28 — — US disclosed
WO-1992021669-A1 2-PHENYLBENZO[B]FURANS AND THIOPHENES, METHODS OF PREPARING THEM AND PHARMACEUTICAL PREPARATIONS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-10 — — WO disclosed
EP-0516257-A1 Phenylbenzo[b]furans and -thiophenes, procedures for their preparation, and pharmaceutical compositions containing the same SCHERING AKTIENGESELLSCHAFT (DE) 1992-12-02 — — EP disclosed
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