SCHEMBL11855441

SCHEMBL11855441

COc1cc(Oc2c(Cl)cc(C(F)(F)F)cc2Cl)ccc1C#N

nearest known ligand 0.55

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 17/20 0.55
PGR P06401 3/20 0.51

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
SCHEMBL11440595 0.84 AR (0.43) ARPGR
SCHEMBL11856899 0.84 AR (0.53) ARPGR
SCHEMBL11780345 0.84 NPBWR1 (0.43) ARPGR
SCHEMBL11447794 0.82 PPARA (0.43) ARPGR
SCHEMBL10443317 0.82 AR (0.47) ARPGR
SCHEMBL11447790 0.81 PGR (0.43) ARPGR
SCHEMBL11436032 0.81 PTGDR2 (0.45) ARPGR
SCHEMBL16319486 0.81 AR (0.61) AR
SCHEMBL11434991 0.80 AR (0.39) ARPGR
SCHEMBL11854888 0.80 NPBWR1 (0.41) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3954829-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-05-04 US claimed
US-3954829-A HERBICIDES BAYER AKTIENGESELLSCHAFT (DT) 1976-05-04 US disclosed