SCHEMBL6499776

SCHEMBL6499776

CC1=CC(=O)N(c2ccc(C(F)(F)F)c(F)c2)C1=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
XPO1 O14980 6/20 0.42
AR P10275 11/20 0.42
GRM2 Q14416 1/20 0.38
PPARG P37231 1/20 0.38
PPARD Q03181 1/20 0.38
PPARA Q07869 1/20 0.38

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
SCHEMBL24939780 0.80 NOTUM (0.44) XPO1AR
SCHEMBL94147 0.76 MGLL (0.46)
SCHEMBL27920612 0.75 KAT2B (0.37) XPO1
SCHEMBL28434063 0.75 MGLL (0.53)
SCHEMBL24939862 0.75 PIM3 (0.41)
SCHEMBL96043 0.73 MGLL (0.52) XPO1
SCHEMBL5699260 0.72 L3MBTL1 (0.43) XPO1
SCHEMBL1116215 0.71 KMT2A (0.41)
SCHEMBL3686454 0.71 KMT2A (0.41)
SCHEMBL8142750 0.71 MGLL (0.57)

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
US-6861432-B2 Piperazine derivatives that destabilize androgen receptors SCHERING AKTIENGESELLSCHAFT (DE) 2005-03-01 US disclosed