SCHEMBL7786228

SCHEMBL7786228

CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=O)N1CCCCI

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.81
PGR P06401 1/20 0.81

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
SCHEMBL633929 0.94 AR (0.88) ARPGR
Ru-58841 SCHEMBL1461459 0.90 AR (1.00) ARPGR
Ru-58841 SCHEMBL29372187 0.90 AR (1.00) ARPGR
SCHEMBL5579470 0.90 AR (0.81) ARPGR
SCHEMBL4032680 0.90 PGR (0.81) ARPGR
SCHEMBL3875038 0.89 AR (0.75) ARPGR
SCHEMBL3873665 0.89 AR (0.75) ARPGR
SCHEMBL3871464 0.89 AR (0.75) ARPGR
SCHEMBL3873391 0.89 AR (0.75) ARPGR
SCHEMBL630193 0.89 AR (0.80) ARPGR

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
EP-0869946-B1 PHENYLIMIDAZOLIDINES AND USE THEREOF AS AN ANTIANDROGENIC AGENT AVENTIS PHARMA SA (FR) 2001-10-31 EP disclosed
US-6242611-B1 SUCH AS 4-(4,4-DIMETHYL-2,5-DIOXO-3-(4-NITROOXYBUTYL) -1-IMIDAZOLIDINYL)-2-(TRIFLUOROMETHYL)BENZONITRILE USED AS ANTIANDROGENIC COMPOUNDS HOECHST MARION ROUSSEL (FR) 2001-06-05 US disclosed
EP-0869946-A1 PHENYLIMIDAZOLIDINES AND USE THEREOF AS AN ANTIANDROGENIC AGENT HOECHST MARION ROUSSEL (FR) 1998-10-14 EP disclosed
WO-1997023464-A1 PHENYLIMIDAZOLIDINES AND USE THEREOF AS AN ANTIANDROGENIC AGENT HOECHST MARION ROUSSEL (FR) 1997-07-03 WO disclosed