SCHEMBL29095027

SCHEMBL29095027

O=C(O)Cc1ccccc1NC(=O)c1cc(Br)c2cc[nH]c2c1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ SUCNR1 Q9BXA5 12/20 0.49
▸ NR1H4 Q96RI1 1/20 0.49
▸ CFD P00746 4/20 0.48
▸ F11 P03951 2/20 0.48
▸ TPSB2 P20231 1/20 0.48
▸ PARP1 P09874 1/20 0.42
▸ TYMS P04818 1/20 0.40
▸ DHPS P49366 1/20 0.40

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
SCHEMBL21439726 0.85 PKM (0.43) SUCNR1NR1H4CFDDHPS
SCHEMBL21439661 0.79 CFD (0.60) SUCNR1NR1H4CFDF11TPSB2
SCHEMBL28510884 0.79 CFD (0.64) SUCNR1NR1H4CFDF11TPSB2
SCHEMBL21439515 0.78 CFD (0.74) SUCNR1CFDF11TPSB2
SCHEMBL16396581 0.78 NR1H4 (0.60) SUCNR1NR1H4CFDF11TPSB2
SCHEMBL28516387 0.76 CFD (0.56) SUCNR1NR1H4CFDF11TPSB2
SCHEMBL21439639 0.76 CFD (0.59) SUCNR1CFDF11TPSB2
SCHEMBL21711305 0.74 NR1H4 (0.75) SUCNR1NR1H4CFDF11TPSB2
SCHEMBL16396849 0.73 NR1H4 (0.55) SUCNR1NR1H4CFDF11TPSB2
SCHEMBL29095199 0.73 CFD (0.52) SUCNR1NR1H4CFDF11TPSB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112272553-B Substituted benzofurans, benzopyrroles, benzothiophenes and structurally related complement inhibitors 拜奥克里斯特制药公司 2023-09-22 — — CN disclosed
Send feedback