SCHEMBL27880682

SCHEMBL27880682

[CH2]C(C)n1ccc(-c2ccc(C#N)c(Cl)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 17/20 0.46
CYP11B2 P19099 1/20 0.41
CASP1 P29466 1/20 0.41
EGLN2 Q96KS0 1/20 0.41

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
SCHEMBL1813269 0.84 AR (0.46) ARCASP1EGLN2
SCHEMBL1813265 0.84 AR (0.46) ARCASP1EGLN2
SCHEMBL1815502 0.84 AR (0.46) ARCASP1EGLN2
SCHEMBL20046772 0.80 SCN9A (0.48) ARCYP11B2CASP1EGLN2
SCHEMBL12080136 0.77 AR (0.42) ARCYP11B2CASP1EGLN2
SCHEMBL1812527 0.76 AR (0.57) ARCASP1
SCHEMBL1813547 0.76 AR (0.57) ARCASP1
SCHEMBL1812528 0.76 AR (0.57) ARCASP1
SCHEMBL24428288 0.76 AR (0.52) ARCYP11B2CASP1
SCHEMBL1816945 0.75 AR (0.56) ARCASP1

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-102596910-A Androgen receptor modulating compounds ORION CORP 2012-07-18 CN disclosed