SCHEMBL14749332

SCHEMBL14749332

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

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PRCP P42785 5/20 0.54
▸ BTK Q06187 2/20 0.44
▸ ALDH1A1 P00352 4/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ MAPT P10636 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ PAX8 Q06710 1/20 0.37
▸ EGFR P00533 1/20 0.37
▸ PROKR1 Q8TCW9 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
SCHEMBL14749330 0.86 PRCP (0.57) PRCPALDH1A1SMN1; SMN2HRH3EGFR
SCHEMBL14749326 0.85 PRCP (0.55) PRCPALDH1A1SMN1; SMN2HRH3PAX8
SCHEMBL14749348 0.85 PRCP (0.51) PRCPALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL14749328 0.85 PRCP (0.61) PRCPALDH1A1MAPTSMN1; SMN2PROKR1
SCHEMBL14736875 0.84 PRCP (0.59) PRCPKDM4EMEN1KMT2APOLB
SCHEMBL14749343 0.84 PRCP (0.56) PRCPALDH1A1KDM4EMAPTHRH3
SCHEMBL14749364 0.84 PRCP (0.55) PRCPBTKALDH1A1KDM4EMAPT
SCHEMBL14749336 0.84 PRCP (0.55) PRCPBTKALDH1A1KDM4EMAPT
SCHEMBL14749316 0.84 PRCP (0.57) PRCPALDH1A1KDM4EMAPTSMN1; SMN2
SCHEMBL14749342 0.84 PRCP (0.53) PRCPALDH1A1KDM4EMAPTSMN1; 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 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 1/4885BTK 4669/4885ALDH1A1 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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