SCHEMBL8316231

SCHEMBL8316231

CC(C)(C)c1csc(-c2cc3cc(OCc4cccc(C#N)c4)ccc3o2)n1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAOB P27338 7/20 0.46
MAOA P21397 2/20 0.44
F2RL3 Q96RI0 5/20 0.41
GRM5 P41594 1/20 0.39
FFAR1 O14842 2/20 0.39
FFAR4 Q5NUL3 1/20 0.39
CYP4F2 P78329 1/20 0.38
CYP4A11 Q02928 1/20 0.38

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
SCHEMBL8316881 0.83 MRGPRX4 (0.52)
SCHEMBL8314160 0.81 MRGPRX4 (0.48) MAOBMAOA
SCHEMBL8311107 0.81 CHRM2 (0.41) MAOBF2RL3
SCHEMBL8311729 0.81 F2RL3 (0.35) MAOBF2RL3
SCHEMBL8314965 0.79 F2RL3 (0.35) MAOBF2RL3
SCHEMBL6599597 0.78 F2RL3 (0.33) MAOBF2RL3
SCHEMBL8314208 0.77 F2RL3 (0.36) MAOBF2RL3
SCHEMBL1080157 0.77 F2RL3 (0.36) MAOBF2RL3
SCHEMBL6598601 0.76 F2RL3 (0.38) F2RL3
SCHEMBL8314939 0.76 MAOB (0.34) MAOBMAOAF2RL3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0528337-B1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO (JP) 1999-10-20 EP disclosed
US-5296495-A Antiallergens, antiinflammatory FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-03-22 US disclosed
EP-0528337-A1 New thiazolylbenzofuran derivatives, processes for the preparation thereof and pharmaceutical composition comprising the same FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1993-02-24 EP disclosed