SCHEMBL5710583

SCHEMBL5710583

NCCCc1cc(C(=O)NCC23CC4CC(CC(C4)C2)C3)c(Cl)cn1

nearest known ligand 0.68

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.68

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
Hydrochloric Acid SCHEMBL5710531 0.99 P2RX7 (0.67) P2RX7
SCHEMBL5710443 0.90 P2RX7 (0.75) P2RX7
SCHEMBL6662981 0.88 P2RX7 (0.71) P2RX7
SCHEMBL5710475 0.88 P2RX7 (0.68) P2RX7
Hydrochloric Acid SCHEMBL5710713 0.87 P2RX7 (0.67) P2RX7
Hydrochloric Acid SCHEMBL5710674 0.87 P2RX7 (0.67) P2RX7
SCHEMBL5076164 0.86 P2RX7 (0.69) P2RX7
SCHEMBL5074755 0.86 P2RX7 (0.73) P2RX7
SCHEMBL5077420 0.86 P2RX7 (0.66) P2RX7
SCHEMBL5710693 0.85 P2RX7 (0.68) 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-1448195-B1 N-ADAMANTYLMETHYL DERIVATES AND INTERMEDIATES AS PHARMACEUTICAL COMPOSITIONS AND PROCESSES FOR THEIR PREPARATION ASTRAZENECA AB (SE) 2006-11-02 EP claimed