SCHEMBL20569602

SCHEMBL20569602

O=c1[nH]cc(SCCc2ccc(Cl)cc2)cc1Cl

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DAO P14920 17/20 0.55
GPR84 Q9NQS5 1/20 0.45
CDC7 O00311 1/20 0.39
DBF4 Q9UBU7 1/20 0.39

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
SCHEMBL20569899 0.86 DAO (0.75) DAOGPR84
SCHEMBL20570332 0.82 DAO (0.52) DAOGPR84
SCHEMBL20569629 0.78 DAO (0.71) DAO
SCHEMBL20570300 0.75 DAO (0.73) DAOGPR84
SCHEMBL20570125 0.73 DAO (0.61) DAO
SCHEMBL20570574 0.72 DAO (0.79) DAO
SCHEMBL20570156 0.72 DAO (0.76) DAO
SCHEMBL14488039 0.71 DAO (1.00) DAO
SCHEMBL21331798 0.69 CYP1A2 (0.61)
SCHEMBL27670852 0.68 ALPG (0.44) GPR84

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-2018216823-A1 ALPHA-AMINO AMIDE DERIVATIVES TAISHO PHARMACEUTICAL CO., LTD. (JP) 2018-11-29 WO disclosed