SCHEMBL12175464

SCHEMBL12175464

Clc1cc(Cl)cc(C2OC3(CCN(Cc4ccccn4)CC3)c3ccccc32)c1

nearest known ligand 0.76

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 18/20 0.76
▸ OPRD1 P41143 1/20 0.46
▸ KCNH2 Q12809 1/20 0.46
▸ SIGMAR1 Q99720 1/20 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
SCHEMBL12175515 0.90 PRCP (0.69) PRCPOPRD1KCNH2SIGMAR1
SCHEMBL14650811 0.89 PRCP (0.72) PRCPOPRD1KCNH2SIGMAR1
SCHEMBL12175514 0.89 PRCP (0.72) PRCPOPRD1KCNH2SIGMAR1
SCHEMBL14650864 0.86 PRCP (0.82) PRCPSIGMAR1
SCHEMBL15894616 0.86 PRCP (0.80) PRCPSIGMAR1
SCHEMBL12175508 0.86 PRCP (0.80) PRCPSIGMAR1
SCHEMBL12175472 0.86 PRCP (1.00) PRCP
SCHEMBL15894622 0.86 PRCP (0.68) PRCPSIGMAR1
SCHEMBL15898455 0.86 PRCP (0.73) PRCPOPRD1
SCHEMBL15894626 0.85 PRCP (0.81) PRCPOPRD1SIGMAR1

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 1/4885OPRD1 2918/4885KCNH2 3705/4885

“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.

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