SCHEMBL14849783

SCHEMBL14849783

Clc1ccc(-c2nc(-c3ncccn3)c([C@@H]3CC[C@@H](c4ccccc4)NC3)[nH]2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 6/20 1.00
▸ MAPK13 O15264 9/20 0.44
▸ MAPK12 P53778 9/20 0.44
▸ MAPK11 Q15759 9/20 0.44
▸ MAPK14 Q16539 9/20 0.44
▸ RAF1 P04049 2/20 0.44
▸ GCGR P47871 9/20 0.43
▸ AURKA O14965 1/20 0.37
▸ ADORA3 P0DMS8 1/20 0.36
▸ ADORA1 P30542 1/20 0.36

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
SCHEMBL14849781 1.00 PRCP (1.00) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14849667 0.90 PRCP (0.81) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14856996 0.90 PRCP (0.81) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14849764 0.90 PRCP (0.81) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14849684 0.90 PRCP (0.81) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14849804 0.82 PRCP (0.69) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14849873 0.82 PRCP (0.69) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14849752 0.80 PRCP (0.66) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14840905 0.78 PRCP (0.63) PRCPMAPK13MAPK12MAPK11MAPK14
SCHEMBL14840577 0.77 PRCP (0.63) PRCPMAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9006268-B2 Prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP. (US) 2015-04-14 — — US disclosed
US-9006268-B2 Prolylcarboxypeptidase inhibitors MERCK SHARP & DOHME CORP. (US) 2015-04-14 — — US disclosed
US-20130090324-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME LLC 2013-04-11 — — US disclosed
US-20130090324-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME LLC 2013-04-11 — — US disclosed
WO-2011156246-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME CORP. (US) 2011-12-15 — — 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-20130090324-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS PRCP, PREP, ENPEP PRCP 1/4885MAPK13 2672/4885MAPK12 3384/4885

“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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