SCHEMBL8315112

SCHEMBL8315112

c1ccc(Cc2nnn[nH]2)c(COc2ccc3oc(-c4nc(C5CCC5)cs4)cc3c2)c1

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 1/20 0.33
FFAR4 Q5NUL3 1/20 0.32
CYP19A1 P11511 1/20 0.31
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
NFKB1 P19838 1/20 0.30
RAB9A P51151 1/20 0.30
NFKB2 Q00653 1/20 0.30
RELA Q04206 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
NDUFS2 O75306 1/20 0.30
CHRM2 P08172 1/20 0.30
CYP2C8 P10632 1/20 0.30
CYP2C9 P11712 1/20 0.30
ADRA2C P18825 1/20 0.30
HTR2B P41595 1/20 0.30
HTR3A P46098 1/20 0.30
HTR6 P50406 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
SCHEMBL8311024 0.97 FFAR4 (0.34) F2RL3FFAR4CYP19A1NDUFS2CHRM2
SCHEMBL8313166 0.85 MAPK1 (0.36) F2RL3CYP19A1ALDH1A1MAPT
SCHEMBL8315851 0.85 NPC1 (0.39) F2RL3CYP19A1NPC1ALDH1A1MAPT
SCHEMBL8316157 0.84 F2RL3 (0.37) F2RL3FFAR4CYP19A1NPC1ALDH1A1
SCHEMBL8315236 0.83 F2RL3 (0.32) F2RL3
Hydrochloric Acid SCHEMBL8315734 0.83 CYP19A1 (0.37) F2RL3CYP19A1ALDH1A1LMNAMAPT
SCHEMBL8312101 0.83 MAPT (0.38) F2RL3CYP19A1NPC1ALDH1A1LMNA
SCHEMBL8310707 0.83 F2RL3 (0.31) F2RL3
SCHEMBL8310428 0.83 F2RL3 (0.33) F2RL3
SCHEMBL8316352 0.83 F2RL3 (0.33) F2RL3ALDH1A1

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