SCHEMBL20215323

SCHEMBL20215323

COc1cn(Cc2ccccc2C)c(-c2cccc(Cl)c2)nc1=O

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.57

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
SCHEMBL20215332 0.89 P2RX7 (0.56) P2RX7
SCHEMBL20215324 0.88 P2RX7 (0.58) P2RX7
SCHEMBL20215322 0.87 P2RX7 (0.61) P2RX7
SCHEMBL20215326 0.87 P2RX7 (0.52) P2RX7
SCHEMBL20215331 0.85 P2RX7 (0.59) P2RX7
SCHEMBL20215329 0.84 P2RX7 (0.55) P2RX7
SCHEMBL20215327 0.81 P2RX7 (0.54) P2RX7
SCHEMBL20215339 0.81 P2RX7 (0.63) P2RX7
SCHEMBL20215330 0.78 P2RX7 (0.55) P2RX7
SCHEMBL20215325 0.76 P2RX7 (0.56) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9988373-B2 Nitrogen-containing six-membered cyclic derivatives and pharmaceutical composition comprising the same SHIONOGI & CO., LTD. (JP) 2018-06-05 US disclosed
US-9988373-B2 Nitrogen-containing six-membered cyclic derivatives and pharmaceutical composition comprising the same SHIONOGI & CO., LTD. (JP) 2018-06-05 US disclosed