SCHEMBL23949829

SCHEMBL23949829

COc1cccc(C(=O)NCC23CC(F)C4CCC(F)(C2)CC4(F)C3)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 18/20 0.46
P2RY12 Q9H244 1/20 0.43
KCNA3 P22001 2/20 0.39

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
SCHEMBL23949831 0.80 P2RX7 (0.66) P2RX7P2RY12
SCHEMBL23949841 0.80 P2RX7 (0.61) P2RX7P2RY12
SCHEMBL23949833 0.78 P2RX7 (0.66) P2RX7P2RY12
SCHEMBL23949830 0.74 P2RX7 (0.45) P2RX7P2RY12
SCHEMBL23950062 0.71 LMNA (0.47) P2RX7P2RY12KCNA3
SCHEMBL23950059 0.69 P2RX7 (0.67) P2RX7P2RY12
SCHEMBL23949832 0.68 P2RX7 (0.46) P2RX7
SCHEMBL21769577 0.67 P2RX7 (0.63) P2RX7P2RY12
SCHEMBL7217917 0.66 LMNA (0.60) P2RX7
SCHEMBL23949847 0.65 P2RX7 (0.58) P2RX7P2RY12

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-20210323910-A1 ADAMANTANYL-SUBSTITUTED BENZAMIDE COMPOUNDS AND THEIR USE AS P2X7 RECEPTOR ANTAGONISTS THE UNIVERSITY OF SYDNEY (AU) 2021-10-21 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-20210323910-A1 ADAMANTANYL-SUBSTITUTED BENZAMIDE COMPOUNDS AND THEIR USE AS P2X7 RECEPTOR ANTAGONISTS P2RX1, P2RX3, P2RX5 P2RX7 4/4885P2RY12 14/4885KCNA3 145/4885

“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.