SCHEMBL19622908

SCHEMBL19622908

CCC(=O)N1CCC(Nc2ccc(F)cc2)CC1

nearest known ligand 0.72

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 11/20 0.72
MLNR O43193 4/20 0.58
CYP3A4 P08684 2/20 0.58
MAPT P10636 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
GAA P10253 1/20 0.54

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
SCHEMBL2716077 0.84 EPHX2 (1.00) EPHX2
SCHEMBL16422849 0.82 KMT2A (0.51) EPHX2MLNRCYP3A4MAPTKDM4E
SCHEMBL7470380 0.81 KMT2A (0.50) EPHX2MLNRCYP3A4MAPTKDM4E
SCHEMBL1704119 0.80 MLNR (0.70) EPHX2MLNRCYP3A4ALDH1A1
SCHEMBL1704864 0.78 MLNR (0.68) EPHX2MLNRCYP3A4
SCHEMBL1703969 0.77 MLNR (0.63) EPHX2MLNRCYP3A4MAPTALDH1A1
SCHEMBL27904819 0.77 MLNR (0.66) MLNRCYP3A4KDM4EALDH1A1GAA
SCHEMBL377801 0.77 ALDH1A1 (0.75) MAPTKDM4EALDH1A1GAA
SCHEMBL3327432 0.77 ALDH1A1 (0.46) EPHX2MLNRCYP3A4MAPTKDM4E
SCHEMBL3327437 0.77 ALDH1A1 (0.46) EPHX2MLNRCYP3A4MAPTKDM4E

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-2528604-B1 ACYL PIPERIDINE INHIBITORS OF SOLUBLE EPOXIDE HYDROLASE UNIV CALIFORNIA (US) 2017-11-22 EP disclosed