SCHEMBL17751386

SCHEMBL17751386

CCN(CCN=O)C1=CC(=O)C(Nc2ccc(ON)c(Cl)c2)=CC1=O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ P2RX3 P56373 1/20 0.33
▸ MAPT P10636 1/20 0.31
▸ MAPK1 P28482 1/20 0.31

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
SCHEMBL17751345 0.88 P2RX3 (0.33) P2RX3MAPTMAPK1
SCHEMBL17751366 0.80 DNM1 (0.36) —
SCHEMBL15039426 0.73 DNM1 (0.37) P2RX3MAPTMAPK1
SCHEMBL15020967 0.69 MAPT (0.33) MAPT
SCHEMBL15039277 0.67 ALDH1A1 (0.39) MAPT
SCHEMBL15020510 0.66 DNM1 (0.41) MAPTMAPK1
SCHEMBL17751346 0.65 STAT3 (0.33) —
SCHEMBL15020301 0.65 DNM1 (0.56) MAPTMAPK1
SCHEMBL15039427 0.65 DNM1 (0.42) MAPTMAPK1
SCHEMBL17751347 0.64 — —

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-2791106-B1 PARTICULAR QUINONE DIRECT DYES, DYE COMPOSITION COMPRISING AT LEAST ONE SUCH DYE, IMPLEMENTATION PROCESS THEREFOR AND USE THEROF OREAL (FR) 2016-05-18 — — EP disclosed
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