SCHEMBL7554887

SCHEMBL7554887

O=C(NCC12CC3CC(CC(C3)C1)C2)c1cc(CC2CCCNC2)ccc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 19/20 1.00

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
SCHEMBL7660333 0.88 P2RX7 (1.00) P2RX7
SCHEMBL7666342 0.84 P2RX7 (0.74) P2RX7
SCHEMBL7662131 0.83 P2RX7 (0.71) P2RX7
SCHEMBL7660351 0.79 P2RX7 (0.67) P2RX7
SCHEMBL7661827 0.79 P2RX7 (0.68) P2RX7
SCHEMBL7555019 0.79 P2RX7 (0.67) P2RX7
SCHEMBL5553057 0.79 P2RX7 (0.69) P2RX7
SCHEMBL5553872 0.79 P2RX7 (0.69) P2RX7
SCHEMBL5549329 0.79 P2RX7 (0.69) P2RX7
SCHEMBL7665315 0.78 P2RX7 (0.75) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6492355-B1 Adamantane derivatives ASTRAZENECA AB (SE) 2002-12-10 US claimed
US-6492355-B1 Adamantane derivatives ASTRAZENECA AB (SE) 2002-12-10 US disclosed
EP-1171432-A1 ADAMANTANE DERIVATIVES AstraZeneca AB (SE) 2002-01-16 EP disclosed
WO-2000061569-A1 ADAMANTANE DERIVATIVES ASTRAZENECA AB (SE) 2000-10-19 WO disclosed