SCHEMBL10055624

SCHEMBL10055624

COC(=O)CCn1c(=O)[nH]/c(=N\c2ccc(OC(C)C)c(C)c2)n(Cc2ccc(Cl)cc2)c1=O

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 20/20 0.53

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
SCHEMBL10057016 0.93 P2RX3 (0.60) P2RX3
SCHEMBL10056321 0.92 P2RX3 (0.58) P2RX3
SCHEMBL17590240 0.91 P2RX3 (0.58) P2RX3
SCHEMBL17590410 0.89 P2RX3 (0.61) P2RX3
SCHEMBL10056907 0.89 P2RX3 (0.62) P2RX3
SCHEMBL10057100 0.88 P2RX3 (0.59) P2RX3
SCHEMBL10056443 0.88 P2RX3 (0.60) P2RX3
SCHEMBL10056883 0.88 P2RX3 (0.61) P2RX3
SCHEMBL17590991 0.87 P2RX3 (0.61) P2RX3
SCHEMBL10055919 0.87 P2RX3 (0.62) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012020749-A1 TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOUND THAT CONTAINS SAME AND EXHIBITS ANALGESIC ACTIVITY 塩野義製薬株式会社 (JP) 2012-02-16 — — WO disclosed
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