SCHEMBL28049098

SCHEMBL28049098

CCC(F)(F)CCC(N)=O

nearest known ligand 0.34

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.34
CYP1A2 P05177 3/20 0.34
KMT2A Q03164 3/20 0.34
ALDH1A1 P00352 1/20 0.34
THRB P10828 1/20 0.34
FAAH O00519 9/20 0.33
SOAT1 P35610 2/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C19 P33261 1/20 0.33
CNR1 P21554 1/20 0.31
CES1 P23141 5/20 0.31
CES2 O00748 2/20 0.31
HSD17B10 Q99714 1/20 0.31
KDM4E B2RXH2 2/20 0.31
NOS3 P29474 1/20 0.30
NOS1 P29475 1/20 0.30
NOS2 P35228 1/20 0.30

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
SCHEMBL12886188 0.78 ALDH1A1 (0.50) MEN1CYP1A2KMT2AALDH1A1THRB
SCHEMBL20223162 0.78 ALDH1A1 (0.43) MEN1CYP1A2KMT2AALDH1A1THRB
SCHEMBL31521027 0.76
SCHEMBL470517 0.76 L3MBTL1 (0.31)
SCHEMBL29887024 0.75
SCHEMBL1030177 0.75
SCHEMBL1032750 0.75
SCHEMBL30608971 0.74 CYP1A2 (0.39) MEN1CYP1A2KMT2AALDH1A1THRB
SCHEMBL429299 0.74
SCHEMBL16710789 0.73 KMT2A (0.35) MEN1CYP1A2KMT2AALDH1A1THRB

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
CN-105209446-A GPR120 agonists for the treatment of type ii diabetes JANSSEN PHARMACEUTICA NV 2015-12-30 CN disclosed