SCHEMBL21229230

SCHEMBL21229230

COc1cccc(OC)c1-c1cc(C(=O)NC(CCc2ccccc2)C(=O)NC2CCC2)nn1CC(C)C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 20/20 1.00

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
SCHEMBL17326453 1.00 APLNR (1.00) APLNR
SCHEMBL17326462 0.93 APLNR (0.87) APLNR
SCHEMBL17326449 0.92 APLNR (0.86) APLNR
SCHEMBL18964208 0.92 APLNR (0.85) APLNR
SCHEMBL18964195 0.92 APLNR (0.85) APLNR
SCHEMBL21468119 0.89 APLNR (0.80) APLNR
SCHEMBL17326757 0.89 APLNR (0.80) APLNR
SCHEMBL18964101 0.88 APLNR (1.00) APLNR
SCHEMBL17326461 0.88 APLNR (0.78) APLNR
SCHEMBL18963703 0.87 APLNR (0.80) APLNR

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-10377718-B2 Apelin receptor (APJ) agonists and uses thereof RESEARCH TRIANGLE INSTITUTE (US) 2019-08-13 — — US claimed

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-10377718-B2 Apelin receptor (APJ) agonists and uses thereof APLNR, AP1G1, APMAP APLNR 1/4885

“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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