SCHEMBL14749283

SCHEMBL14749283

Cc1ccc(-c2cc(C3CCCN(C(=O)NCCc4ccc(F)cc4)C3)n(-c3ncccn3)n2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 4/20 0.49
▸ GPBAR1 Q8TDU6 5/20 0.48
▸ HSD17B10 Q99714 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ EPHX2 P34913 2/20 0.39
▸ KIT P10721 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39

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
SCHEMBL12184132 0.96 PRCP (0.51) PRCPGPBAR1HSD17B10MEN1KMT2A
SCHEMBL14749414 0.92 PRCP (0.51) PRCPGPBAR1POLBMAPTMAPK1
SCHEMBL14749384 0.92 PRCP (0.51) PRCPGPBAR1HSD17B10POLBMAPK1
SCHEMBL14749316 0.86 PRCP (0.57) PRCPGPBAR1POLBMAPTMAPK1
SCHEMBL14749383 0.85 PRCP (0.49) PRCPEPHX2CYP2C9
SCHEMBL14736554 0.85 PRCP (0.51) PRCPGPBAR1POLBMAPTALDH1A1
SCHEMBL14749412 0.83 PRCP (0.50) PRCPMAPTMAPK1SMN1; SMN2ALDH1A1
SCHEMBL14749396 0.83 PRCP (0.51) PRCPKMT2AALDH1A1EPHX2CYP2C9
SCHEMBL14749374 0.82 PRCP (0.51) PRCP
SCHEMBL14749394 0.82 PRCP (0.56) PRCPMAPTKMT2AALDH1A1EPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130059830-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS MERCK SHARP & DOHME CORP 2013-03-07 — — 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-20130059830-A1 NOVEL PROLYLCARBOXYPEPTIDASE INHIBITORS PRCP, PREP, ENPEP PRCP 1/4885GPBAR1 1882/4885HSD17B10 254/4885

“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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