SCHEMBL14849812

SCHEMBL14849812

COC(=O)N1C[C@@H](c2[nH]c(-c3ccc(Cl)cc3)nc2-c2ncccn2)CC[C@@H]1c1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 5/20 0.59
▸ KCNK3 O14649 1/20 0.37
▸ KCNK9 Q9NPC2 1/20 0.37
▸ FFAR2 O15552 2/20 0.37
▸ RAF1 P04049 2/20 0.37
▸ PSD A5PKW4 1/20 0.35
▸ HSD11B1 P28845 1/20 0.34
▸ IDO1 P14902 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ P2RX7 Q99572 1/20 0.34
▸ MAPK13 O15264 1/20 0.33
▸ MAPK12 P53778 1/20 0.33
▸ MAPK11 Q15759 1/20 0.33
▸ MAPK14 Q16539 1/20 0.33
▸ TNKS O95271 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ SLC6A7 Q99884 1/20 0.33

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
SCHEMBL14849808 1.00 PRCP (0.59) PRCPKCNK3KCNK9FFAR2RAF1
SCHEMBL14840577 0.90 PRCP (0.63) PRCPFFAR2RAF1HSD11B1MAPK13
SCHEMBL14849784 0.90 PRCP (0.59) PRCPKCNK3KCNK9FFAR2RAF1
SCHEMBL14849787 0.90 PRCP (0.59) PRCPKCNK3KCNK9FFAR2RAF1
SCHEMBL16512920 0.76 PRCP (0.49) PRCPRAF1MAPK13MAPK12MAPK11
SCHEMBL14840859 0.75 PRCP (0.66) PRCPHSD11B1MAPK11MAPK14SLC6A7
SCHEMBL14849769 0.75 PRCP (1.00) PRCP
SCHEMBL14849806 0.75 PRCP (1.00) PRCP
SCHEMBL14849781 0.74 PRCP (1.00) PRCPRAF1MAPK13MAPK12MAPK11
SCHEMBL14849783 0.74 PRCP (1.00) PRCPRAF1MAPK13MAPK12MAPK11

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 3 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

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 1/4885KCNK3 4500/4885KCNK9 4030/4885

“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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