SCHEMBL6601063

SCHEMBL6601063

COc1ccc2c(c1)c(C(=O)O)nn2Cc1ccc2oc(-c3nc(C(C)(C)C)cs3)cc2c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.40
ALDH1A1 P00352 2/20 0.39
GAA P10253 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 1/20 0.38
PTGER4 P35408 2/20 0.38
MAOB P27338 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
PDE5A O76074 1/20 0.35
PTGES O14684 1/20 0.34
ALOX5 P09917 1/20 0.34
F2RL3 Q96RI0 2/20 0.34
FFAR1 O14842 1/20 0.34
KDM4E B2RXH2 1/20 0.34
NPC1 O15118 1/20 0.34
MAPT P10636 1/20 0.34
HPGD P15428 1/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
APP P05067 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
SCHEMBL6601472 0.93 KMT2A (0.40) MCL1ALDH1A1KMT2APTGER4MAOB
SCHEMBL6597890 0.93 MAOB (0.40) MCL1ALDH1A1KMT2APTGER4MAOB
SCHEMBL8659965 0.88 MEN1 (0.40) ALDH1A1GAAPKMKMT2APTGER4
SCHEMBL6598987 0.85 KMT2A (0.33) ALDH1A1GAAKMT2AMAOBPTGDR2
SCHEMBL6599253 0.85 F2RL3 (0.39) PKMF2RL3S1PR1
SCHEMBL7533433 0.83 APP (0.35) MCL1ALDH1A1GAAMAOBKDM4E
SCHEMBL7475913 0.82 KMT2A (0.32) MCL1ALDH1A1KMT2AMAOBMAPT
SCHEMBL6600128 0.82 F2RL3 (0.37) MCL1GAAF2RL3MAPTSMN1; SMN2
SCHEMBL6601187 0.82 PLA2G2A (0.49) ALDH1A1KMT2A
SCHEMBL6600027 0.81 PDE5A (0.34) ALDH1A1KMT2AMAOBPDE5APTGES

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-1170009-B1 Thiazolybenzofuran derivatives and their use as SRS-A and leukotiene antagonists FUJISAWA PHARMACEUTICAL CO (JP) 2004-04-07 EP disclosed
EP-1170009-A2 Thiazolybenzofuran derivatives and their use as SRS-A and leukotiene antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-01-09 EP disclosed
US-5994378-A ANTIALLERGENS; ANTIINFLAMMATORY AGENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1999-11-30 US disclosed
EP-0880519-A1 THIAZOLYLBENZOFURAN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-12-02 EP disclosed
WO-1997027190-A1 THIAZOLYLBENZOFURAN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-07-31 WO disclosed