SCHEMBL15417145

SCHEMBL15417145

C=C(Nc1cccc(Cn2nc(-c3ccc(C(=O)NCCCCN)cc3)ccc2=O)c1)OCC

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 5/20 0.54
▸ HDAC1 Q13547 10/20 0.45

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
SCHEMBL13994577 0.98 MET (0.55) METHDAC1
SCHEMBL13247316 0.92 MET (0.64) METHDAC1
SCHEMBL13994268 0.90 MET (0.56) METHDAC1
SCHEMBL13247318 0.90 MET (0.65) METHDAC1
SCHEMBL15417100 0.88 MET (0.54) METHDAC1
SCHEMBL13247324 0.86 MET (0.67) METHDAC1
SCHEMBL13247342 0.86 MET (0.64) METHDAC1
SCHEMBL13994271 0.85 MET (0.62) MET
SCHEMBL13994632 0.85 MET (0.61) MET
SCHEMBL13247149 0.85 MET (0.65) METHDAC1

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-2150539-B1 PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2013-12-18 — — EP disclosed
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