SCHEMBL14749289

SCHEMBL14749289

Cc1ccc(-c2cc([C@@H]3CC[C@H](CCc4ccccc4)NC3)n(-c3ncccn3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 10/20 0.56
▸ NPC1 O15118 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ STAT1 P42224 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ DRD2 P14416 4/20 0.34
▸ DRD4 P21917 4/20 0.34
▸ DRD3 P35462 2/20 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
SCHEMBL12183895 0.91 PRCP (0.56) PRCPDRD2DRD4DRD3
SCHEMBL14737307 0.91 PRCP (0.56) PRCPDRD2DRD4DRD3
SCHEMBL14749293 0.84 PRCP (0.49) PRCPNPC1ALDH1A1MAPTSTAT1
SCHEMBL14749291 0.84 PRCP (0.46) PRCPNPC1ALDH1A1MAPTSTAT1
SCHEMBL14701326 0.81 PRCP (0.83) PRCPALDH1A1DRD2DRD4DRD3
SCHEMBL14736790 0.76 PRCP (0.58) PRCPNPC1RAB9ASMN1; SMN2DRD2
SCHEMBL12184022 0.76 PRCP (0.58) PRCPNPC1RAB9ASMN1; SMN2DRD2
SCHEMBL14749290 0.75 PRCP (0.47) PRCPALDH1A1MAPTSMN1; SMN2
SCHEMBL2598787 0.75 PRCP (0.56) PRCPNPC1MAPTRAB9ASMN1; SMN2
SCHEMBL12184580 0.75 PRCP (0.56) PRCPNPC1MAPTRAB9ASMN1; SMN2

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 1/4885NPC1 1944/4885ALDH1A1 661/4885

“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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