SCHEMBL12175475

SCHEMBL12175475

Clc1cc(Cl)cc(C2OC3(CCN(CC4CCCCC4)CC3)c3ccccc32)c1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 10/20 0.61
▸ OPRM1 P35372 1/20 0.47
▸ OPRL1 P41146 1/20 0.47
▸ SIGMAR1 Q99720 3/20 0.46

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
SCHEMBL12175477 0.97 PRCP (0.62) PRCPSIGMAR1
SCHEMBL14650822 0.95 PRCP (0.64) PRCPSIGMAR1
SCHEMBL11870243 0.82 OPRD1 (0.52) PRCPOPRM1SIGMAR1
SCHEMBL12175587 0.80 PRCP (0.65) PRCPSIGMAR1
SCHEMBL12175515 0.79 PRCP (0.69) PRCPSIGMAR1
SCHEMBL12175511 0.78 PRCP (0.60) PRCPSIGMAR1
SCHEMBL11859408 0.78 OPRD1 (0.47) PRCPOPRM1SIGMAR1
SCHEMBL12175464 0.77 PRCP (0.76) PRCPSIGMAR1
SCHEMBL12175582 0.77 PRCP (0.59) PRCPSIGMAR1
SCHEMBL12175514 0.77 PRCP (0.72) PRCPSIGMAR1

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-2563764-B1 NOVEL SPIROPIPERIDINE PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME (US) 2015-02-25 — — EP disclosed
US-8785634-B2 Spiropiperidine prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP (US) 2014-07-22 — — US disclosed
US-8785634-B2 Spiropiperidine prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP (US) 2014-07-22 — — US disclosed
US-20130023515-A1 NOVEL SPIROPIPERIDINE PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-01-24 — — US disclosed
US-20130023515-A1 NOVEL SPIROPIPERIDINE PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME CORP. 2013-01-24 — — US disclosed
WO-2011137024-A1 NOVEL SPIROPIPERIDINE PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-11-03 — — 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-20130023515-A1 NOVEL SPIROPIPERIDINE PROLYLCARBOXYPEPTIDASE INHIBITORS PRCP, PREP, PEPD PRCP 1/4885OPRM1 4383/4885OPRL1 2773/4885

“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.

Send feedback