SCHEMBL27654875

SCHEMBL27654875

CCC(=O)OCCc1cccc(C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.54
TAAR1 Q96RJ0 1/20 0.50
THRB P10828 1/20 0.48
PRKCA P17252 1/20 0.48
PRKCD Q05655 1/20 0.48
MAOB P27338 2/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
SIRT2 Q8IXJ6 1/20 0.47
ACP3 P15309 1/20 0.47
FFAR4 Q5NUL3 1/20 0.46
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
HTT P42858 2/20 0.46
ALDH1A1 P00352 1/20 0.46
NR1I2 O75469 1/20 0.46
ADRB1 P08588 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46

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
SCHEMBL8789673 0.85 ALOX5 (0.56) ALOX5TAAR1THRBPRKCAPRKCD
SCHEMBL23049789 0.85 PRKCA (0.60) THRBPRKCAPRKCDMAOBACP3
SCHEMBL28561124 0.82 TAAR1 (0.57) ALOX5TAAR1PRKCAPRKCDMAOB
SCHEMBL22857498 0.82 PPARA (0.47) ALOX5TAAR1MAOBHDAC1HDAC8
SCHEMBL3248128 0.81 ALOX5 (0.50) ALOX5TAAR1THRBPRKCAPRKCD
SCHEMBL2761647 0.81 ALOX5 (0.52) ALOX5TAAR1THRBPRKCAPRKCD
SCHEMBL901880 0.80 FFAR4 (0.55) ALOX5TAAR1THRBPRKCAPRKCD
SCHEMBL15736550 0.80 TAAR1 (0.47) TAAR1THRBPRKCAPRKCDMAOB
Hydrochloric Acid SCHEMBL27533447 0.79 ALOX5 (0.50) ALOX5TAAR1MAOBSIRT2KDM4E
SCHEMBL27986144 0.79 FFAR1 (0.46) MAOBFFAR4KDM4EHTTALDH1A1

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
CN-105209446-A GPR120 agonists for the treatment of type ii diabetes JANSSEN PHARMACEUTICA NV 2015-12-30 CN disclosed
CN-1922143-A Alpha- (trifluoromethyl-substituted aryloxy, arylamino, arylthio or arylmethyl) -trifluoromethyl-substituted phenylacetic acids and derivatives as antidiabetics METABOLEX INC (US) 2007-02-28 CN disclosed