SCHEMBL6600670

SCHEMBL6600670

COC(=O)c1ccc2oc(-c3nc(C(C)(C)C)cs3)cc2c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.47
POLB P06746 2/20 0.47
THRB P10828 1/20 0.47
HDAC6 Q9UBN7 2/20 0.40
KDM4E B2RXH2 5/20 0.37
NPC1 O15118 5/20 0.37
RAB9A P51151 5/20 0.37
KMT2A Q03164 3/20 0.37
ALDH1A1 P00352 2/20 0.37
HPGD P15428 2/20 0.37
MEN1 O00255 2/20 0.37
SMN1; SMN2 Q16637 5/20 0.37
MAPT P10636 4/20 0.37
HTT P42858 2/20 0.37
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
ATM Q13315 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL6598130 0.87 NPC1 (0.37) TP53POLBTHRBHDAC6KDM4E
SCHEMBL6598772 0.87 TP53 (0.45) TP53POLBHDAC6KDM4ENPC1
Hydrochloric Acid SCHEMBL6598785 0.85 NPC1 (0.37) TP53POLBHDAC6KDM4ENPC1
SCHEMBL6598142 0.83 PTPN1 (0.37) TP53POLBHDAC6KDM4ENPC1
SCHEMBL8314160 0.83 MRGPRX4 (0.48) KDM4ENPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL6598947 0.83 ALDH1A1 (0.42) TP53POLBTHRBHDAC6KDM4E
SCHEMBL6599211 0.81 APP (0.35) KDM4ENPC1RAB9AKMT2AALDH1A1
SCHEMBL8313990 0.80 KMT2A (0.41) TP53POLBNPC1RAB9AKMT2A
SCHEMBL8310999 0.80 KDM4E (0.50) KDM4ENPC1RAB9AKMT2AALDH1A1
SCHEMBL6600736 0.79 ESR1 (0.48) POLBKDM4ENPC1RAB9AKMT2A

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 6 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-0880519-B1 THIAZOLYLBENZOFURAN DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO (JP) 2002-04-17 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