SCHEMBL1147356

SCHEMBL1147356

CCc1ccc(NC(=O)C2(N)CCN(S(=O)(=O)c3c(Cl)cccc3Cl)CC2)cc1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
NPSR1 Q6W5P4 2/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP2C19 P33261 1/20 0.45
MAPT P10636 6/20 0.43
ATM Q13315 1/20 0.42
RECQL P46063 1/20 0.42
LMNA P02545 2/20 0.41
TP53 P04637 1/20 0.41
MET P08581 1/20 0.41
POLB P06746 1/20 0.41
HTT P42858 1/20 0.41
CCR1 P32246 1/20 0.41

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
SCHEMBL1147263 0.88 EPHX2 (0.53) MEN1KMT2ANPSR1GAATSHR
SCHEMBL1147387 0.88 PKM (0.54) MEN1KMT2ANPSR1GAATSHR
SCHEMBL15387532 0.85 MEN1 (0.43) MEN1KMT2ANPSR1GAATSHR
SCHEMBL1147347 0.85 TP53 (0.53) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL1147319 0.84 MEN1 (0.54) MEN1KMT2AGAAALDH1A1CYP2C19
SCHEMBL12874959 0.82 SCN3A (0.51) ALDH1A1MAPTLMNATP53POLB
SCHEMBL1147138 0.82 MAPT (0.46) MEN1KMT2ANPSR1GAATSHR
SCHEMBL1147397 0.82 MAPT (0.46) MEN1KMT2ANPSR1GAATSHR
SCHEMBL1147507 0.81 MEN1 (0.53) MEN1KMT2AGAAALDH1A1LMNA
SCHEMBL1146852 0.81 MAPT (0.55) MEN1KMT2AALDH1A1MAPTTP53

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 8 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-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
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

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 MEN1 2306/4885KMT2A 1526/4885NPSR1 138/4885

“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.