SCHEMBL6598987

SCHEMBL6598987

COc1ccc2c(c1)c(C#N)nn2Cc1ccc2oc(-c3nc(C(C)(C)C)cs3)cc2c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.33
F2RL3 Q96RI0 5/20 0.33
PTGES O14684 1/20 0.33
ALOX5 P09917 1/20 0.33
MAOB P27338 2/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PDE5A O76074 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
ADRA2C P18825 1/20 0.32
FAAH O00519 1/20 0.31
TSHR P16473 1/20 0.31
PFKFB2 O60825 1/20 0.30
PFKFB1 P16118 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
SCHEMBL6599799 0.86 XDH (0.38) KMT2AMAPTADRA2AADRA2BADRA2C
SCHEMBL6601063 0.85 MCL1 (0.40) KMT2AF2RL3PTGESALOX5MAOB
SCHEMBL6597890 0.84 MAOB (0.40) KMT2AF2RL3PTGESALOX5MAOB
SCHEMBL6601472 0.84 KMT2A (0.40) KMT2AF2RL3PTGESALOX5MAOB
SCHEMBL6600915 0.82 PDE5A (0.34) KMT2AF2RL3PTGESALOX5MAOB
SCHEMBL6600027 0.82 PDE5A (0.34) KMT2AF2RL3PTGESALOX5MAOB
SCHEMBL6600909 0.81 PDE5A (0.34) KMT2AF2RL3PTGESALOX5MAOB
SCHEMBL6599467 0.78 XDH (0.35) PFKFB2PFKFB1PFKFB3
SCHEMBL8310999 0.77 KDM4E (0.50) KMT2AF2RL3PTGESMAOBMAPT
SCHEMBL6601187 0.77 PLA2G2A (0.49) KMT2AALDH1A1LMNA

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