SCHEMBL8311024

SCHEMBL8311024

c1ccc(Cc2nnn[nH]2)c(COc2ccc3oc(-c4nc(C5CC5)cs4)cc3c2)c1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.34
F2RL3 Q96RI0 1/20 0.34
CYP19A1 P11511 1/20 0.32
NDUFS2 O75306 1/20 0.31
CHRM2 P08172 1/20 0.31
CYP2C8 P10632 1/20 0.31
CYP2C9 P11712 1/20 0.31
ADRA2C P18825 1/20 0.31
HTR2B P41595 1/20 0.31
HTR3A P46098 1/20 0.31
HTR6 P50406 1/20 0.31
KCNH2 Q12809 1/20 0.31
TMEM97 Q5BJF2 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
S1PR1 P21453 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
SCHEMBL8315112 0.97 F2RL3 (0.33) FFAR4F2RL3CYP19A1NDUFS2CHRM2
SCHEMBL8313166 0.87 MAPK1 (0.36) F2RL3CYP19A1
SCHEMBL8315851 0.86 NPC1 (0.39) F2RL3CYP19A1ADRA2C
SCHEMBL8315236 0.85 F2RL3 (0.32) F2RL3
Hydrochloric Acid SCHEMBL8315734 0.85 CYP19A1 (0.37) F2RL3CYP19A1
SCHEMBL8312101 0.85 MAPT (0.38) F2RL3CYP19A1
SCHEMBL8316352 0.84 F2RL3 (0.33) F2RL3
SCHEMBL8310707 0.84 F2RL3 (0.31) F2RL3
SCHEMBL8310428 0.84 F2RL3 (0.33) F2RL3
SCHEMBL8311970 0.84 MAPT (0.43) CYP19A1CYP2C8CYP2C9

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 2 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
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