SCHEMBL14749378

SCHEMBL14749378

Cc1cccc(CCCN2CCCC(c3cc(-c4ccc(F)cc4)nn3-c3ncccn3)C2)c1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 6/20 0.49
▸ PDE2A O00408 1/20 0.39
▸ DRD2 P14416 5/20 0.39
▸ GAA P10253 1/20 0.39
▸ SLC6A4 P31645 1/20 0.39
▸ SLC6A3 Q01959 1/20 0.39
▸ CCR3 P51677 2/20 0.38
▸ DRD3 P35462 4/20 0.38
▸ DRD1 P21728 3/20 0.38
▸ DRD5 P21918 3/20 0.38
▸ DRD4 P21917 2/20 0.38
▸ HRH3 Q9Y5N1 2/20 0.38
▸ HTR1A P08908 1/20 0.37
▸ HTR2A P28223 1/20 0.37

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
SCHEMBL14749374 0.92 PRCP (0.51) PRCPPDE2ADRD2GAASLC6A4
SCHEMBL14749368 0.85 PRCP (0.67) PRCPDRD2DRD3HRH3HTR2A
SCHEMBL14749404 0.85 PRCP (0.45) PRCPPDE2AHRH3
SCHEMBL14749367 0.84 PRCP (0.54) PRCPDRD2DRD3DRD1DRD5
SCHEMBL14749424 0.83 LMNA (0.47) PRCPPDE2AHRH3
SCHEMBL14749369 0.81 PRCP (0.59) PRCPPDE2ADRD2DRD3DRD4
SCHEMBL14737072 0.81 PRCP (0.52) PRCPPDE2ADRD2DRD3HRH3
SCHEMBL14749379 0.79 PRCP (0.59) PRCPSLC6A4SLC6A3HRH3
SCHEMBL14749377 0.77 PRCP (0.51) PRCPPDE2ADRD2DRD3DRD4
SCHEMBL14749344 0.77 PRCP (0.53) PRCPDRD2DRD3DRD4HRH3

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 2 patents. 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
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 1/4885PDE2A 1477/4885DRD2 4864/4885

“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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