SCHEMBL6572993

SCHEMBL6572993

CN(C)C(=O)CNCCNc1ccc(Cl)c(C(=O)NCC23CC4CC(CC(C4)C2)C3)c1

nearest known ligand 0.58

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.58

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
SCHEMBL6572489 0.92 P2RX7 (0.57) P2RX7
SCHEMBL6571547 0.88 P2RX7 (0.62) P2RX7
SCHEMBL6573186 0.85 P2RX7 (0.61) P2RX7
SCHEMBL7570693 0.85 P2RX7 (0.64) P2RX7
SCHEMBL6572601 0.85 P2RX7 (0.63) P2RX7
Hydrochloric Acid SCHEMBL7573056 0.84 P2RX7 (0.65) P2RX7
SCHEMBL6571938 0.84 P2RX7 (0.62) P2RX7
SCHEMBL6575181 0.84 P2RX7 (0.63) P2RX7
SCHEMBL6572842 0.84 P2RX7 (0.59) P2RX7
Hydrochloric Acid SCHEMBL6572589 0.84 P2RX7 (0.62) P2RX7

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
EP-1240132-B1 ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2004-04-07 EP disclosed