SCHEMBL14736583

SCHEMBL14736583

O=C(O)N1CC(CO)OCC1CCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.39
SLC18A2 Q05940 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
SCHEMBL14736894 0.84 LMNA (0.41) DRD4
SCHEMBL2597852 0.84 KLK7 (0.41)
SCHEMBL18577112 0.75 CHIT1 (0.48)
SCHEMBL28692423 0.75 CHIT1 (0.48)
SCHEMBL16966497 0.74 HCRTR1 (0.31)
SCHEMBL26605561 0.73 OPRD1 (0.36)
SCHEMBL2597809 0.71 KLK7 (0.42)
SCHEMBL17005468 0.71 PDK1 (0.35)
SCHEMBL17005432 0.71 PDK1 (0.30)
SCHEMBL4961994 0.69 SLC18A2 (0.55) SLC18A2

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 DRD4 4740/4885SLC18A2 4451/4885

“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.