SCHEMBL1147136

SCHEMBL1147136

Cc1ccc(S(=O)(=O)N2CCC(O)(C(=O)Nc3ccc(C(C)(C)C)cc3)CC2)cc1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.55
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
MAPK1 P28482 1/20 0.55
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
TRPV4 Q9HBA0 1/20 0.53
LMNA P02545 3/20 0.53
ALDH1A1 P00352 2/20 0.53
PKM P14618 1/20 0.53
USP2 O75604 1/20 0.53
GAA P10253 2/20 0.52
MAPT P10636 1/20 0.52
CYP2C19 P33261 1/20 0.50

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
SCHEMBL1147276 0.88 KMT2A (0.57) HSD11B1MEN1KMT2ACYP1A2CYP3A4
SCHEMBL1147416 0.88 MEN1 (0.54) HSD11B1MEN1KMT2AMAPK1CYP1A2
Hydrochloric Acid SCHEMBL1147381 0.87 MEN1 (0.53) HSD11B1MEN1KMT2AMAPK1CYP1A2
SCHEMBL1147278 0.86 MAPT (0.50) MEN1KMT2AMAPK1LMNAALDH1A1
SCHEMBL1147298 0.84 RAB9A (0.61) MEN1KMT2AMAPK1CYP1A2CYP3A4
SCHEMBL15387816 0.84 MEN1 (0.55) HSD11B1MEN1KMT2AMAPK1CYP1A2
SCHEMBL1147162 0.83 HSD11B1 (0.46) HSD11B1TRPV4MAPT
SCHEMBL1147254 0.83 EPHX2 (0.65) MEN1KMT2AMAPK1CYP1A2CYP3A4
SCHEMBL1146709 0.83 KMT2A (0.55) MEN1KMT2AMAPK1LMNAALDH1A1
SCHEMBL1146694 0.82 GAA (0.48) HSD11B1MEN1KMT2AMAPK1CYP1A2

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 9 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
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 HSD11B1 3837/4885MEN1 2306/4885KMT2A 1526/4885

“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.