SCHEMBL7476880

SCHEMBL7476880

CC(C)(C)c1csc(-c2cc3cc(Cn4nc5ccccc5c4C(N)=O)ccc3o2)n1

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGER4 P35408 12/20 0.36
ALDH1A1 P00352 2/20 0.35
HSD17B10 Q99714 2/20 0.35
HPGD P15428 1/20 0.35
ALOX15 P16050 1/20 0.35
MAOB P27338 2/20 0.34
CYP26A1 O43174 1/20 0.34
CYP26B1 Q9NR63 1/20 0.34
TP53 P04637 1/20 0.34
TSHR P16473 1/20 0.34
STAT1 P42224 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
KCNH2 Q12809 1/20 0.34
POLB P06746 1/20 0.33

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
SCHEMBL6598376 0.87 PTGER4 (0.39) PTGER4
SCHEMBL6599144 0.85 CPT1A (0.39) PTGER4ALDH1A1HSD17B10MAOBCYP26A1
SCHEMBL6601175 0.83 TSHR (0.33) ALDH1A1HSD17B10HPGDALOX15TP53
SCHEMBL8659965 0.81 MEN1 (0.40) PTGER4ALDH1A1HSD17B10CYP26A1CYP26B1
SCHEMBL6600548 0.80 TP53 (0.31) TP53TSHRSTAT1
SCHEMBL7533433 0.79 APP (0.35) ALDH1A1HSD17B10HPGDMAOBCYP26A1
SCHEMBL6602150 0.78 CCR2 (0.48) ALDH1A1HSD17B10MAOBCYP26A1CYP26B1
SCHEMBL7469206 0.77 MAOB (0.31) MAOBCYP26A1CYP26B1
SCHEMBL6597890 0.77 MAOB (0.40) PTGER4ALDH1A1HPGDMAOB
SCHEMBL6599253 0.77 F2RL3 (0.39)

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-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