SCHEMBL17326208

SCHEMBL17326208

CCC(C)Cn1nc(C(=O)N[C@@H](CC(C)C)C(=O)N(C)CC(=O)OC)cc1-c1c(OC)cccc1OC

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 16/20 0.55
▸ NTSR1 P30989 4/20 0.44
▸ OPRM1 P35372 1/20 0.44
▸ OPRD1 P41143 1/20 0.44

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
SCHEMBL17326212 0.94 APLNR (0.55) APLNRNTSR1OPRM1OPRD1
SCHEMBL17326190 0.93 APLNR (0.62) APLNRNTSR1OPRM1OPRD1
SCHEMBL21229202 0.93 APLNR (0.62) APLNRNTSR1OPRM1OPRD1
SCHEMBL21249518 0.89 APLNR (0.46) APLNRNTSR1OPRM1OPRD1
SCHEMBL17326689 0.88 APLNR (0.63) APLNR
SCHEMBL17326201 0.87 APLNR (0.68) APLNR
SCHEMBL21468330 0.86 APLNR (0.44) APLNRNTSR1OPRM1OPRD1
SCHEMBL17326327 0.85 APLNR (0.58) APLNRNTSR1OPRM1OPRD1
SCHEMBL21468314 0.85 APLNR (0.58) APLNRNTSR1OPRM1OPRD1
SCHEMBL17326206 0.84 APLNR (0.48) APLNRNTSR1OPRM1OPRD1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160207889-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE 2016-07-21 — — US disclosed
US-20160207889-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE 2016-07-21 — — US disclosed
WO-2015188073-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF RESEARCH TRIANGLE INSTITUTE (US) 2015-12-10 — — WO 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-20160207889-A1 APELIN RECEPTOR (APJ) AGONISTS AND USES THEREOF APLNR, AP1G1, APMAP APLNR 1/4885NTSR1 15/4885OPRM1 172/4885

“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.

Send feedback