SCHEMBL8071783

SCHEMBL8071783

Nc1cccc(Cl)c1C(=O)NCCC12CCCC(CCC1)C2.[CH2]

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 4/20 0.60
SLC6A9 P48067 16/20 0.43

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
SCHEMBL7576533 0.85 P2RX7 (0.78) P2RX7
SCHEMBL7966259 0.82 P2RX7 (0.72) P2RX7
SCHEMBL7571057 0.76 P2RX7 (1.00) P2RX7
SCHEMBL8086064 0.73 P2RX7 (0.73) P2RX7
SCHEMBL8732695 0.70 P2RX7 (0.58) P2RX7SLC6A9
SCHEMBL24515745 0.69 P2RX7 (0.60) P2RX7SLC6A9
SCHEMBL9017627 0.69 MAPK14 (0.55) P2RX7
SCHEMBL8932345 0.67 P2RX7 (0.57) P2RX7SLC6A9
SCHEMBL7690936 0.67 P2RX7 (0.73) P2RX7
SCHEMBL24209849 0.67 JAK1 (0.59) P2RX7SLC6A9

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1036059-A1 ADAMANTANE DERIVATIVES AstraZeneca UK Limited (GB) 2000-09-20 EP disclosed
WO-1999029661-A1 ADAMANTANE DERIVATIVES ASTRAZENECA UK LIMITED (GB) 1999-06-17 WO disclosed