SCHEMBL20215345

SCHEMBL20215345

COc1cn(Cc2ccccc2)c(-c2ccc(Cl)cc2Cl)nc1=O

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.66

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
SCHEMBL20215364 0.91 P2RX7 (0.66) P2RX7
SCHEMBL20215351 0.86 P2RX7 (0.63) P2RX7
SCHEMBL20215344 0.83 P2RX7 (0.64) P2RX7
SCHEMBL20215320 0.83 P2RX7 (0.65) P2RX7
SCHEMBL20215365 0.82 P2RX7 (0.61) P2RX7
SCHEMBL20215342 0.81 P2RX7 (0.64) P2RX7
SCHEMBL20215347 0.81 P2RX7 (0.61) P2RX7
SCHEMBL19906520 0.79 P2RX7 (1.00) P2RX7
SCHEMBL20215346 0.78 P2RX7 (0.57) P2RX7
SCHEMBL19906588 0.78 P2RX7 (0.64) 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