SCHEMBL26564181

SCHEMBL26564181

Cn1ncc2c1Nc1ccc(O)cc1N(C(=O)c1ccccc1)C2

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AVPR1A P37288 19/20 0.58
OXTR P30559 9/20 0.58
AVPR2 P30518 5/20 0.58
TSPO P30536 1/20 0.48

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
SCHEMBL26185550 0.89 AVPR1A (0.60) AVPR1AOXTRAVPR2TSPO
SCHEMBL30045753 0.89 AVPR1A (0.60) AVPR1AOXTRAVPR2TSPO
SCHEMBL30045802 0.89 AVPR1A (0.60) AVPR1AOXTRAVPR2TSPO
SCHEMBL20277678 0.88 AVPR1A (0.57) AVPR1AOXTRAVPR2TSPO
SCHEMBL30047020 0.88 AVPR1A (0.68) AVPR1AOXTRAVPR2TSPO
SCHEMBL20276925 0.88 AVPR1A (0.68) AVPR1AOXTRAVPR2TSPO
SCHEMBL2130893 0.87 AVPR1A (0.65) AVPR1AOXTRAVPR2TSPO
SCHEMBL26185558 0.87 AVPR1A (0.55) AVPR1AOXTRAVPR2
SCHEMBL30045852 0.87 AVPR1A (0.55) AVPR1AOXTRAVPR2
SCHEMBL20277537 0.86 AVPR1A (0.54) AVPR1AOXTRAVPR2TSPO

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-20230330103-A1 NON-PEPTIDE OXYTOCIN RECEPTOR AGONISTS Kinoxis Therapeutics Pty Ltd (AU) 2023-10-19 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-20230330103-A1 NON-PEPTIDE OXYTOCIN RECEPTOR AGONISTS OXTR, AVPR1B, AVPR1A AVPR1A 3/4885OXTR 1/4885AVPR2 5/4885

“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.