SCHEMBL14749329

SCHEMBL14749329

O=C(CCC(F)(F)F)N1CCCC(c2cc(-c3ccc(F)cc3)nn2-c2ncccn2)C1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 5/20 0.59
▸ KDM4E B2RXH2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ JAK2 O60674 1/20 0.38
▸ JAK1 P23458 1/20 0.38
▸ GFER P55789 1/20 0.38

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
SCHEMBL14749328 0.91 PRCP (0.61) PRCPALDH1A1SMN1; SMN2MAPTJAK2
SCHEMBL14749330 0.87 PRCP (0.57) PRCPALDH1A1SMN1; SMN2GFER
SCHEMBL14752561 0.86 PRCP (0.62) PRCPKDM4EMEN1KMT2AALDH1A1
SCHEMBL14749345 0.86 PRCP (0.55) PRCPKDM4EALDH1A1MAPT
SCHEMBL14749344 0.85 PRCP (0.53) PRCPALDH1A1MAPTGFER
SCHEMBL14736875 0.85 PRCP (0.59) PRCPKDM4EMEN1KMT2A
SCHEMBL14749365 0.85 PRCP (0.60) PRCPKDM4EMEN1KMT2AALDH1A1
SCHEMBL14749364 0.85 PRCP (0.55) PRCPKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14749336 0.85 PRCP (0.55) PRCPKDM4EALDH1A1SMN1; SMN2MAPT
SCHEMBL14749343 0.85 PRCP (0.56) PRCPKDM4EALDH1A1MAPT

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 1/4885KDM4E 576/4885MEN1 3238/4885

“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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