SCHEMBL4195979

SCHEMBL4195979

CC1(C)C(=O)N(c2ccc(C#N)c(C(F)(F)F)c2)C(=O)N1CCCC(=O)OC1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.67
PGR P06401 1/20 0.67
HDAC1 Q13547 2/20 0.58

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
SCHEMBL4192693 0.90 AR (0.61) ARPGR
SCHEMBL4189953 0.85 AR (0.72) ARPGRHDAC1
SCHEMBL4025056 0.85 AR (0.72) ARPGRHDAC1
SCHEMBL4204207 0.84 AR (0.82) ARPGRHDAC1
SCHEMBL633929 0.82 AR (0.88) ARPGRHDAC1
SCHEMBL2694365 0.81 AR (0.94) ARPGR
SCHEMBL4028572 0.81 AR (0.86) ARPGR
SCHEMBL5579470 0.81 AR (0.81) ARPGR
Ru-58841 SCHEMBL1461459 0.81 AR (1.00) ARPGRHDAC1
Ru-58841 SCHEMBL29372187 0.81 AR (1.00) ARPGRHDAC1

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
WO-2009097996-A1 USE OF SUBSTITUTED PHENYLIMIDAZOLIDINES FOR PRODUCING MEDICAMENTS FOR TREATING METABOLIC SYNDROME SANOFI-AVENTIS (FR) 2009-08-13 WO disclosed
US-6162444-A Cosmetic or pharmaceutical compositions HOECHST MARION ROUSSEL (FR) 2000-12-19 US disclosed