SCHEMBL6598766

SCHEMBL6598766

CC(C)(C)c1csc(-c2cc3cc(C(=O)n4cc(CC(=O)OCc5ccccc5)c5cc(N)ccc54)ccc3o2)n1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C3 P42330 7/20 0.34
AKR1C2 P52895 3/20 0.34
AKR1C4 P17516 1/20 0.32
PTGS1 P23219 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
F2RL3 Q96RI0 1/20 0.31
HTR1A P08908 1/20 0.31
HTR1D P28221 1/20 0.31
HTR1B P28222 1/20 0.31
HTR1F P30939 1/20 0.31
HTR7 P34969 1/20 0.31
HTR6 P50406 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
ALDH1A1 P00352 1/20 0.30
POLB P06746 1/20 0.30
HSD17B10 Q99714 1/20 0.30
F2 P00734 1/20 0.30
PRSS1 P07477 1/20 0.30

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
SCHEMBL6602677 0.89 ELANE (0.33) AKR1C3AKR1C2F2RL3MEN1KMT2A
SCHEMBL6598485 0.83 ALDH1A1 (0.39) L3MBTL1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6599969 0.76 SMN1; SMN2 (0.37) L3MBTL1SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6603373 0.73 PPARD (0.44)
SCHEMBL5810419 0.71 PPARD (0.53) F2RL3ALDH1A1
SCHEMBL6600889 0.70 ALDH1A1 (0.38) SMN1; SMN2MEN1KMT2AALDH1A1POLB
SCHEMBL6599665 0.70 PLA2G2A (0.39) KMT2AALDH1A1F2PRSS1
SCHEMBL6598772 0.69 TP53 (0.45) SMN1; SMN2MEN1KMT2AALDH1A1POLB
SCHEMBL6603445 0.69 CPT1A (0.38) F2RL3SMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL6598493 0.69 ALDH1A1 (0.46) SMN1; SMN2ALDH1A1POLBHSD17B10

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