SCHEMBL24947173

SCHEMBL24947173

N#Cc1ccc(C=O)c2occc12

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.32

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
SCHEMBL19631289 0.81 IMPDH2 (0.34) CYP19A1
SCHEMBL4097626 0.78 ERN1 (0.44)
SCHEMBL2263495 0.74 ERN1 (0.37)
SCHEMBL13453307 0.74 TSHR (0.38) CYP19A1
SCHEMBL24947172 0.74 IMPDH2 (0.31) CYP19A1
SCHEMBL24339440 0.74 ALDH1A1 (0.38)
SCHEMBL2123499 0.74 UPP1 (0.32) CYP19A1
SCHEMBL24947171 0.70 CYP19A1 (0.36) CYP19A1
SCHEMBL2122119 0.70 IMPDH2 (0.54)
SCHEMBL2264012 0.70 ALDH1A1 (0.43)

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
WO-2023000834-A1 BENZIMIDAZOLE OR AZABENZIMIDAZOLE-6-CARBOXYLIC ACID COMPOUND AND USE THEREOF 广州必贝特医药股份有限公司 2023-01-26 WO disclosed