SCHEMBL8939558

SCHEMBL8939558

CN1C(=S)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=O)C1(C(F)(F)F)C(F)(F)F

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 17/20 0.77
HDAC1 Q13547 2/20 0.55
PGR P06401 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
SCHEMBL9412807 0.88 AR (0.67) ARPGR
SCHEMBL30291858 0.87 AR (1.00) ARHDAC1
SCHEMBL1435262 0.87 AR (1.00) ARHDAC1
SCHEMBL8939587 0.86 AR (0.64) ARHDAC1PGR
SCHEMBL8939551 0.84 AR (0.74) ARHDAC1
SCHEMBL7759190 0.84 AR (0.74) ARHDAC1
SCHEMBL1715015 0.83 AR (0.72) AR
SCHEMBL1723670 0.83 AR (0.72) AR
SCHEMBL7760593 0.83 AR (0.72) ARHDAC1PGR
SCHEMBL4031610 0.81 AR (0.80) ARHDAC1PGR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5589497-A ANTIANDROGENS Uclaf, Roussel (FR) 1996-12-31 US disclosed
US-5556983-A ANTIANDROGENS ROUSSEL UCLAF (FR) 1996-09-17 US disclosed
US-5434176-A Antiandrogens ROUSSEL UCLAF (FR) 1995-07-18 US disclosed
EP-0578516-A1 Optionally substituted phenylimidazolidins, process for their preparation, their use as medicaments and the pharmaceutical compositions containing them ROUSSEL UCLAF (FR) 1994-01-12 EP disclosed