SCHEMBL257777

SCHEMBL257777

Cc1ccc(OCc2ccc(F)c(C)c2)c(F)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 7/20 0.57
FFAR4 Q5NUL3 4/20 0.43
DRD4 P21917 3/20 0.41
TMEM97 Q5BJF2 3/20 0.41
SIGMAR1 Q99720 3/20 0.41
RXRA P19793 1/20 0.41
RXRB P28702 1/20 0.41
RXRG P48443 1/20 0.41
PPARA Q07869 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
FFAR1 O14842 3/20 0.40
PTGER1 P34995 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
SCHEMBL26434787 0.86 MRGPRX4 (0.58) MRGPRX4FFAR4LMNAHTTPTGER1
SCHEMBL12260905 0.84 MRGPRX4 (0.42) MRGPRX4FFAR4DRD4TMEM97SIGMAR1
SCHEMBL15588794 0.83 MRGPRX4 (0.56) MRGPRX4FFAR4LMNAHTTFFAR1
SCHEMBL10269467 0.81 ENPP2 (0.44) MRGPRX4FFAR4DRD4TMEM97SIGMAR1
SCHEMBL16210864 0.81 MRGPRX4 (0.53) MRGPRX4LMNAHTT
SCHEMBL171841 0.80 MRGPRX4 (0.68) MRGPRX4FFAR4HTTPTGER1
SCHEMBL10269419 0.80 MAOB (0.51) DRD4TMEM97SIGMAR1
SCHEMBL26698908 0.80 MRGPRX4 (0.56) MRGPRX4FFAR4RXRARXRBRXRG
SCHEMBL23624640 0.78 MRGPRX4 (0.45) MRGPRX4FFAR4PPARAFFAR1
SCHEMBL16210297 0.77 MRGPRX4 (0.53) MRGPRX4FFAR4LMNAHTTPTGER1

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
EP-2399585-A1 Boronic acids and esters as inhibitors of fatty acid amide hydrolase Infinity Pharmaceuticals, Inc. (US) 2011-12-28 EP disclosed