SCHEMBL12875143

SCHEMBL12875143

Cc1ccccc1S(=O)(=O)N1CCC(C)(C(=O)Nc2ccc(CC(F)(F)F)cc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 7/20 0.49
▸ CNR1 P21554 7/20 0.49
▸ LIPE Q05469 1/20 0.44
▸ FAAH O00519 2/20 0.41
▸ EPHX2 P34913 3/20 0.41
▸ TP53 P04637 1/20 0.40
▸ DCTPP1 Q9H773 1/20 0.40
▸ HDAC3 O15379 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ HDAC2 Q92769 1/20 0.40
▸ HDAC6 Q9UBN7 1/20 0.40
▸ GAA P10253 1/20 0.39

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
SCHEMBL12875690 0.90 CHRNB2 (0.50) CNR2CNR1LIPE
SCHEMBL12875711 0.82 LIPE (0.43) CNR2CNR1LIPEEPHX2DCTPP1
SCHEMBL12875713 0.81 LIPE (0.42) CNR2CNR1LIPEEPHX2TP53
SCHEMBL1147138 0.76 MAPT (0.46) CNR2CNR1FAAHEPHX2TP53
SCHEMBL12085011 0.75 LIPE (0.58) LIPEFAAHEPHX2TP53
SCHEMBL1147173 0.75 EPHX2 (0.55) LIPEEPHX2TP53
SCHEMBL1147162 0.75 HSD11B1 (0.46) CNR2CNR1FAAHEPHX2TP53
SCHEMBL12874915 0.75 EPHX2 (0.52) EPHX2GAA
SCHEMBL12874912 0.75 FAAH (0.48) FAAHTP53GAA
SCHEMBL12875147 0.73 MEN1 (0.51) TP53

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
WO-2011012602-A1 PIPERIDINE DERIVATIVES AND THEIR USE TO TREAT OBESITY, DIABETES, DYSLIPIDEMIA AND ATHEROSCLEROSIS F. HOFFMANN-LA ROCHE AG (CH) 2011-02-03 — — WO disclosed
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