SCHEMBL15053573

SCHEMBL15053573

CCOc1ccc(C2=CCN(C(=O)OC(C)(C)C)CC2)cn1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 2/20 0.55
NAMPT P43490 1/20 0.52
CYP11B2 P19099 1/20 0.49
GRM1 Q13255 10/20 0.48
GRM5 P41594 9/20 0.48
PDK4 Q16654 1/20 0.47
PDE4B Q07343 1/20 0.46
WNT3A P56704 1/20 0.46
ATR Q13535 1/20 0.46
BTK Q06187 1/20 0.45
CDK7 P50613 1/20 0.45
CDK13 Q14004 1/20 0.45
CDK12 Q9NYV4 1/20 0.45

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
SCHEMBL22324763 0.89 NAMPT (0.53) GPR119NAMPTCYP11B2GRM1GRM5
SCHEMBL29580437 0.89 NAMPT (0.53) GPR119NAMPTCYP11B2GRM1GRM5
SCHEMBL31510790 0.87 NAMPT (0.52) GPR119NAMPTCYP11B2GRM1GRM5
SCHEMBL29071631 0.85 NAMPT (0.50) NAMPTCYP11B2GRM1GRM5PDK4
SCHEMBL30487298 0.85 NAMPT (0.50) NAMPTCYP11B2GRM1GRM5PDK4
SCHEMBL23306173 0.84 NAMPT (0.55) NAMPTCYP11B2GRM1GRM5PDK4
SCHEMBL29840400 0.84 NAMPT (0.55) NAMPTCYP11B2GRM1GRM5PDK4
SCHEMBL29891644 0.84 NAMPT (0.55) NAMPTCYP11B2GRM1GRM5PDK4
SCHEMBL29840385 0.84 NAMPT (0.55) NAMPTCYP11B2GRM1GRM5PDK4
SCHEMBL15095872 0.84 NAMPT (0.55) NAMPTCYP11B2GRM1GRM5PDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2794587-B1 NEW PIPERIDINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2016-03-16 EP disclosed
US-8765959-B2 Piperidine derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-01 US disclosed
US-8765959-B2 Piperidine derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-01 US disclosed
US-8765959-B2 Piperidine derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-07-01 US disclosed
US-20130165444-A1 Piperidine Derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-27 US disclosed
US-20130165444-A1 Piperidine Derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-06-27 US 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-20130165444-A1 Piperidine Derivatives PPARD, FABP4, PLIN5 GPR119 5/4885NAMPT 372/4885CYP11B2 1159/4885

“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.