SCHEMBL2152667

SCHEMBL2152667

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

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 12/20 0.57
▸ HRH3 Q9Y5N1 1/20 0.47
▸ MAPT P10636 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ PDE4A P27815 1/20 0.41
▸ PDE4B Q07343 1/20 0.41
▸ PDE4C Q08493 1/20 0.41
▸ PDE4D Q08499 1/20 0.41

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) METHRH3MAPTSMN1; SMN2MEN1
SCHEMBL2152783 0.90 MAPT (0.49) METHRH3MAPTSMN1; SMN2MEN1
SCHEMBL3112660 0.86 MET (0.49) METMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL2152612 0.84 MET (0.55) METHRH3MAPTSMN1; SMN2
SCHEMBL2152422 0.83 SUCNR1 (0.47) METHRH3MAPTSMN1; SMN2
SCHEMBL3119810 0.83 MEN1 (0.50) METHRH3MAPTSMN1; SMN2MEN1
SCHEMBL3112440 0.83 MEN1 (0.50) METMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3119589 0.83 MEN1 (0.50) METMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL2153009 0.83 MET (0.71) MET
SCHEMBL3103580 0.82 MEN1 (0.48) METMAPTSMN1; SMN2MEN1KMT2A

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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