SCHEMBL15038581

SCHEMBL15038581

CC(C)Oc1ccc(Nc2cc(=O)n(CCCC(=O)N=O)c(=O)n2Cc2ccc(Cl)cc2)cc1Cl

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.84

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
SCHEMBL10048145 0.92 P2RX3 (1.00) P2RX3
SCHEMBL15215763 0.90 P2RX3 (1.00) P2RX3
SCHEMBL10048219 0.86 P2RX3 (1.00) P2RX3
SCHEMBL15038629 0.84 P2RX3 (0.83) P2RX3
SCHEMBL10048374 0.82 P2RX3 (1.00) P2RX3
SCHEMBL10048392 0.81 P2RX3 (1.00) P2RX3
SCHEMBL10048373 0.81 P2RX3 (1.00) P2RX3
SCHEMBL15215755 0.81 P2RX3 (1.00) P2RX3
SCHEMBL15038644 0.80 P2RX3 (1.00) P2RX3
SCHEMBL15038662 0.75 P2RX3 (0.83) P2RX3

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-2604260-B1 NOVEL HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME SHIONOGI & CO (JP) 2017-05-10 — — EP disclosed
EP-2604260-A1 NOVEL HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Shionogi&Co., Ltd. (JP) 2013-06-19 — — EP disclosed
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