SCHEMBL5325952

SCHEMBL5325952

CCN1CCN(c2ccc(C(F)(F)F)cc2C(=O)NC(C)Cc2ccc(OC(C)(C)C(=O)O)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 10/20 0.51
PPARD Q03181 9/20 0.51
CHRM4 P08173 3/20 0.46
CHRM1 P11229 3/20 0.46
CHRM5 P08912 2/20 0.46
CHRM3 P20309 2/20 0.46
CHRM2 P08172 1/20 0.46
MC4R P32245 1/20 0.41
CNR1 P21554 1/20 0.40
SRPK1 Q96SB4 3/20 0.39
PPARG P37231 3/20 0.39
SLC6A5 Q9Y345 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
SCHEMBL5324085 0.92 PPARA (0.48) PPARAPPARDMC4RCNR1PPARG
SCHEMBL14399420 0.91 PPARA (0.47) PPARAPPARDMC4RCNR1SRPK1
SCHEMBL5325989 0.91 PPARA (0.47) PPARAPPARDMC4RCNR1SRPK1
SCHEMBL5353768 0.85 PPARA (0.43) PPARAPPARDCNR1PPARG
SCHEMBL14399164 0.84 PPARD (0.43) PPARAPPARDCNR1
SCHEMBL5330018 0.84 PPARA (0.47) PPARAPPARDMC4RCNR1PPARG
SCHEMBL5326681 0.81 CNR1 (0.48) PPARAPPARDCNR1PPARG
SCHEMBL5329478 0.80 PPARA (0.54) PPARAPPARDCNR1PPARG
SCHEMBL14399396 0.79 CNR1 (0.44) PPARAPPARDCNR1PPARG
SCHEMBL14399348 0.79 CNR1 (0.44) PPARAPPARDCNR1PPARG

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-2007118963-A2 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed
WO-2007118963-A2 SUBSTITUTED N-(PHENETHYL)BENZAMIDE DERIVATIVES, PREPARATION AND USES THEREOF GENFIT (FR) 2007-10-25 WO disclosed