SCHEMBL31053809

SCHEMBL31053809

CC(C)(Br)C(=O)Nc1ccc(C#N)c(Cl)c1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 16/20 0.58
IDO1 P14902 1/20 0.54

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
SCHEMBL12050119 1.00 AR (0.58) ARIDO1
SCHEMBL2481947 0.88 AR (0.61) ARIDO1
SCHEMBL16705283 0.86 AR (0.56) ARIDO1
SCHEMBL17643980 0.85 AR (0.64) AR
SCHEMBL2284951 0.85 AR (0.64) AR
SCHEMBL18171617 0.85 AR (0.64) AR
SCHEMBL29850948 0.85 AR (0.64) AR
SCHEMBL25024866 0.84 BLM (0.46) AR
SCHEMBL15359209 0.83 ABCC9 (0.64) AR
SCHEMBL20752878 0.83 AR (0.65) AR

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-118475567-A Heterocyclic derivative, composition and pharmaceutical application thereof 西藏海思科制药有限公司 2024-08-09 CN disclosed