SCHEMBL28227373

SCHEMBL28227373

N#Cc1ccc(N=C=O)cc1C(F)(F)F.O=C(Cl)Cl

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ AR P10275 15/20 0.47
▸ RXRA P19793 1/20 0.45
▸ RXRB P28702 1/20 0.45
▸ RXRG P48443 1/20 0.45
▸ PGR P06401 1/20 0.42
▸ TAS2R14 Q9NYV8 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
SCHEMBL1190703 0.93 AR (0.49) ARRXRARXRBRXRGPGR
Tetrahydrofuran SCHEMBL28675347 0.82 AR (0.41) AR
SCHEMBL189787 0.77 AR (0.49) ARPGR
SCHEMBL4402110 0.77 AR (0.51) ARRXRARXRBRXRGPGR
SCHEMBL1555041 0.74 MAPK1 (0.47) RXRARXRBRXRG
SCHEMBL23877161 0.74 AR (0.53) ARRXRARXRBRXRGPGR
SCHEMBL19500852 0.74 CYP3A4 (0.39) AR
SCHEMBL4404032 0.73 AR (0.51) ARPGR
SCHEMBL18856260 0.73 AR (0.51) ARPGR
SCHEMBL58303 0.73 MAPK1 (0.61) —

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-108218784-A A kind of preparation method of Nilutamide 吴江信凯医药科技有限公司 2018-06-29 — — CN disclosed
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