SCHEMBL1147296

SCHEMBL1147296

CC(C)Oc1ccc(NC(=O)C2(N)CCN(S(=O)(=O)c3ccccc3Cl)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
FAAH O00519 7/20 0.48
EPHX2 P34913 2/20 0.45
LIPE Q05469 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
KMT2A Q03164 4/20 0.42
GLA P06280 1/20 0.42
MEN1 O00255 3/20 0.41
ELOVL6 Q9H5J4 1/20 0.41
ALDH1A1 P00352 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
USP2 O75604 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 1/20 0.41
PNLIP P16233 1/20 0.40

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
SCHEMBL1147145 0.90 FAAH (0.48) FAAHEPHX2LIPEKMT2AMEN1
SCHEMBL1147001 0.89 FAAH (0.48) FAAHEPHX2LIPEL3MBTL1KMT2A
SCHEMBL1147240 0.88 FAAH (0.51) FAAHEPHX2L3MBTL1KMT2AMEN1
Hydrochloric Acid SCHEMBL1147225 0.87 FAAH (0.50) FAAHEPHX2L3MBTL1KMT2AMEN1
SCHEMBL15387479 0.87 FAAH (0.46) FAAHEPHX2LIPEL3MBTL1KMT2A
SCHEMBL1146756 0.85 FAAH (0.63) FAAHEPHX2KMT2AMEN1MAPT
SCHEMBL1147196 0.85 LIPE (0.52) FAAHEPHX2LIPE
SCHEMBL1147272 0.84 LIPE (0.58) FAAHEPHX2LIPETP53MAPT
SCHEMBL1147263 0.84 EPHX2 (0.53) FAAHEPHX2KMT2AMEN1TP53
SCHEMBL15387391 0.83 FAAH (0.47) FAAHEPHX2LIPEL3MBTL1KMT2A

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US claimed
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 claimed
US-8399676-B2 Piperidine derivatives HOFFMAN-LA ROCHE INC. (US) 2013-03-19 US disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES HOFFMANN-LA ROCHE, INC. 2011-02-03 US disclosed
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
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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110028515-A1 NEW PIPERIDINE DERIVATIVES ADRA1D, ADORA1, H1-0 FAAH 2059/4885EPHX2 3415/4885LIPE 4188/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.