SCHEMBL6603445

SCHEMBL6603445

CC(C)(C)c1csc(-c2cc3cc(Cn4nc(C(=O)OCc5ccccc5)c5ccccc54)ccc3o2)n1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 1/20 0.38
SLC16A3 O15427 1/20 0.37
PTGER4 P35408 7/20 0.37
MEN1 O00255 1/20 0.36
LMNA P02545 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
PDE5A O76074 1/20 0.35
F2RL3 Q96RI0 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CYP26A1 O43174 1/20 0.33
CYP26B1 Q9NR63 1/20 0.33
GRN P28799 1/20 0.33
SORT1 Q99523 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 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
SCHEMBL8659965 0.90 MEN1 (0.40) CPT1ASLC16A3PTGER4MEN1KMT2A
SCHEMBL6599144 0.87 CPT1A (0.39) CPT1APTGER4ALDH1A1POLBHSD17B10
SCHEMBL6598376 0.86 PTGER4 (0.39) PTGER4
SCHEMBL6600128 0.84 F2RL3 (0.37) SMN1; SMN2F2RL3POLB
SCHEMBL6599253 0.83 F2RL3 (0.39) F2RL3
SCHEMBL6601472 0.81 KMT2A (0.40) PTGER4KMT2ASMN1; SMN2F2RL3ALDH1A1
SCHEMBL6601063 0.80 MCL1 (0.40) PTGER4KMT2ASMN1; SMN2PDE5AF2RL3
SCHEMBL7533433 0.80 APP (0.35) CPT1ALMNASMN1; SMN2ALDH1A1POLB
SCHEMBL7475913 0.80 KMT2A (0.32) KMT2AALDH1A1POLBHSD17B10
SCHEMBL6598485 0.78 ALDH1A1 (0.39) MEN1KMT2ASMN1; SMN2ALDH1A1POLB

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