SCHEMBL6601718

SCHEMBL6601718

COC(=O)Cc1cn(Cc2ccc3oc(-c4nc(C(C)(C)C)cs4)cc3c2)c2ccc(OCC(=O)N(C)C)cc12

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 3/20 0.38
KDM4E B2RXH2 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HPGD P15428 2/20 0.38
THRA P10827 4/20 0.36
THRB P10828 4/20 0.36
ICMT O60725 5/20 0.36
PPARG P37231 1/20 0.35
PPARD Q03181 1/20 0.35
PPARA Q07869 1/20 0.35
LOXL2 Q9Y4K0 1/20 0.34
KMT2A Q03164 1/20 0.34
TP53 P04637 1/20 0.33
HSD17B10 Q99714 1/20 0.33
F2 P00734 1/20 0.32
F10 P00742 1/20 0.32
PRSS1 P07477 1/20 0.32
LTB4R Q15722 1/20 0.32
LTB4R2 Q9NPC1 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
SCHEMBL6598709 0.92 THRA (0.44) PLA2G2ATHRATHRBICMTPPARG
SCHEMBL6598794 0.88 PLA2G2A (0.47) PLA2G2ATHRATHRBICMTPPARG
SCHEMBL5810585 0.87 PLA2G2A (0.41) PLA2G2ATHRATHRBICMTPPARG
SCHEMBL6597512 0.87 PLA2G2A (0.37) PLA2G2ATHRATHRBICMTPPARG
Acetic Acid SCHEMBL6598580 0.87 S1PR1 (0.40) PLA2G2ATHRATHRBICMTPPARG
SCHEMBL8624729 0.87 THRA (0.46) PLA2G2ATHRATHRBICMTPPARG
SCHEMBL6599665 0.86 PLA2G2A (0.39) PLA2G2AKDM4EALDH1A1ICMTPPARG
SCHEMBL7474848 0.86 ICMT (0.40) PLA2G2AICMTPPARGPPARDPPARA
SCHEMBL5809194 0.85 THRA (0.41) PLA2G2ATHRATHRBICMTPPARG
SCHEMBL6598583 0.85 PLA2G2A (0.38) PLA2G2ATHRATHRBICMTPPARG

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