SCHEMBL7511066

SCHEMBL7511066

NCC[S+]([O-])CCOc1ccc(Cl)c(C(=O)NCC23CCCC(CCC2)C3)c1.[CH2]

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.49
P2RY12 Q9H244 1/20 0.41

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
SCHEMBL7691855 0.96 P2RX7 (0.48) P2RX7P2RY12
SCHEMBL7688347 0.92 P2RX7 (0.48) P2RX7P2RY12
SCHEMBL7689108 0.89 P2RX7 (0.48) P2RX7P2RY12
SCHEMBL6572519 0.88 P2RX7 (0.64) P2RX7
Hydrochloric Acid SCHEMBL6575554 0.88 P2RX7 (0.63) P2RX7
SCHEMBL7522787 0.87 P2RX7 (0.58) P2RX7P2RY12
SCHEMBL7517506 0.86 P2RX7 (0.57) P2RX7P2RY12
SCHEMBL7457550 0.85 P2RX7 (0.50) P2RX7P2RY12
SCHEMBL7689724 0.84 P2RX7 (0.49) P2RX7P2RY12
SCHEMBL7685695 0.84 P2RX7 (0.49) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20020193414-A1 Adamantane derivatives ASTRAZENECA AB (SE) 2002-12-19 US claimed
US-20020193414-A1 Adamantane derivatives ASTRAZENECA AB (SE) 2002-12-19 US disclosed
EP-1240132-A1 ADAMANTANE DERIVATIVES AstraZeneca AB (SE) 2002-09-18 EP disclosed
WO-2001042194-A1 ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2001-06-14 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-20020193414-A1 Adamantane derivatives APP, ADORA1, ADAM17 P2RX7 894/4885P2RY12 1601/4885

“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.