SCHEMBL19907299

SCHEMBL19907299

Cc1nc2cc(C)c(Nc3nc(=O)c(F)cn3Cc3ccc(P)c(F)c3)cc2s1

nearest known ligand 0.77

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 20/20 0.77

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
SCHEMBL19907293 0.92 P2RX7 (0.81) P2RX7
SCHEMBL19907366 0.89 P2RX7 (0.86) P2RX7
SCHEMBL19906502 0.88 P2RX7 (0.81) P2RX7
SCHEMBL19907613 0.88 P2RX7 (0.83) P2RX7
SCHEMBL19907973 0.87 P2RX7 (1.00) P2RX7
SCHEMBL20107120 0.86 P2RX7 (0.81) P2RX7
SCHEMBL19907801 0.86 P2RX7 (0.74) P2RX7
SCHEMBL19907360 0.84 P2RX7 (0.73) P2RX7
SCHEMBL19907358 0.82 P2RX7 (0.86) P2RX7
SCHEMBL19907928 0.82 P2RX7 (0.86) 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-3287443-A1 6-MEMBERED HETEROCYCLIC DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME Shionogi & Co., Ltd (JP) 2018-02-28 EP disclosed