SCHEMBL27930433

SCHEMBL27930433

CC1=NN(c2cccc(Cn3nc(-c4cc(F)cc(F)c4)ccc3=O)c2)C(C=O)C=C1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 15/20 0.54
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ CHEK1 O14757 1/20 0.42
▸ NEK2 P51955 1/20 0.42
▸ LIMK1 P53667 1/20 0.42
▸ TYRO3 Q06418 1/20 0.42
▸ CLK4 Q9HAZ1 1/20 0.42
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL3087791 0.77 MET (0.69) METMEN1KMT2ACHEK1NEK2
SCHEMBL13561689 0.75 MET (0.74) METMEN1KMT2ACHEK1NEK2
SCHEMBL13089798 0.74 MET (0.63) METMEN1KMT2ACHEK1NEK2
SCHEMBL1303077 0.73 MET (0.65) METMEN1KMT2ACHEK1NEK2
SCHEMBL2466743 0.73 MET (0.65) METMEN1KMT2ACHEK1NEK2
SCHEMBL1952616 0.71 MET (0.65) METMEN1KMT2ACHEK1NEK2
SCHEMBL13089765 0.71 MEN1 (0.70) METMEN1KMT2ACHEK1NEK2
SCHEMBL2465601 0.71 MET (0.62) MET
SCHEMBL3084164 0.70 MET (1.00) METMEN1KMT2ACHEK1NEK2
SCHEMBL4130448 0.70 MET (0.69) METMEN1KMT2ACHEK1NEK2

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
CN-101743241-B Pyridazinone derivates MERCK PATENT GMBH 2013-12-25 — — CN disclosed
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