SCHEMBL19986443

SCHEMBL19986443

COCCc1cncc(Cl)c1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 1/20 0.31

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
SCHEMBL20080613 0.79 CYP2E1 (0.30)
SCHEMBL21120989 0.78 DAO (0.32)
SCHEMBL3914802 0.70
SCHEMBL70682 0.70
SCHEMBL6136930 0.68 PDE4D (0.34) BDKRB2
SCHEMBL28148130 0.64 CYP11B1 (0.42)
SCHEMBL3088437 0.64 TAAR1 (0.54)
SCHEMBL32666839 0.64 CDK2 (0.38)
SCHEMBL5643512 0.64
SCHEMBL11315145 0.63 NPSR1 (0.40)

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-2018050110-A1 NOVEL CAPSID PROTEIN ASSEMBLY INHIBITOR 正大天晴药业集团股份有限公司 2018-03-22 WO disclosed