SCHEMBL2152783

SCHEMBL2152783

CCN(C(=O)O)c1cccc(Cn2nc(-c3ccc(OCCOC)cc3)ccc2=O)c1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.49
▸ SMN1; SMN2 Q16637 1/20 0.49
▸ MET P08581 9/20 0.48
▸ HRH3 Q9Y5N1 1/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KMT2A Q03164 2/20 0.45
▸ PDE4A P27815 1/20 0.45
▸ PDE4B Q07343 1/20 0.45
▸ PDE4C Q08493 1/20 0.45
▸ PDE4D Q08499 1/20 0.45
▸ HDAC1 Q13547 1/20 0.42
▸ 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

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
SCHEMBL2152510 0.91 HRH3 (0.48) MAPTSMN1; SMN2METHRH3MEN1
SCHEMBL2152667 0.90 MET (0.57) MAPTSMN1; SMN2METHRH3MEN1
SCHEMBL2152612 0.85 MET (0.55) MAPTSMN1; SMN2METHRH3
SCHEMBL3112440 0.84 MEN1 (0.50) MAPTSMN1; SMN2METMEN1KMT2A
SCHEMBL3119589 0.84 MEN1 (0.50) MAPTSMN1; SMN2METMEN1KMT2A
SCHEMBL3119810 0.84 MEN1 (0.50) MAPTSMN1; SMN2METHRH3MEN1
SCHEMBL3103580 0.84 MEN1 (0.48) MAPTSMN1; SMN2METMEN1KMT2A
SCHEMBL2152422 0.83 SUCNR1 (0.47) MAPTSMN1; SMN2METHRH3
SCHEMBL3114894 0.82 HDAC1 (0.43) MAPTSMN1; SMN2METMEN1KMT2A
SCHEMBL2152910 0.81 MET (0.61) MAPTSMN1; SMN2METHRH3MEN1

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-2152370-B1 ARYL ETHER PYRIDAZINONE DERIVATIVES MERCK PATENT GMBH (DE) 2011-07-06 — — EP claimed
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