SCHEMBL2152552

SCHEMBL2152552

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

nearest known ligand 0.57

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MET P08581 9/20 0.57
▸ HRH3 Q9Y5N1 1/20 0.49
▸ MAPT P10636 1/20 0.48
▸ SMN1; SMN2 Q16637 1/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ KMT2A Q03164 2/20 0.48

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
SCHEMBL12462920 0.90 MET (0.72) METMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL2152910 0.90 MET (0.61) METHRH3MAPTSMN1; SMN2MEN1
SCHEMBL2153009 0.89 MET (0.71) MET
SCHEMBL12463577 0.88 MET (0.71) MET
SCHEMBL12462938 0.86 MET (0.74) METMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL2152501 0.84 MET (0.65) METHRH3
SCHEMBL3117528 0.84 MET (0.59) METMAPTMEN1KMT2A
SCHEMBL2672593 0.83 ALDH1A1 (0.59) METMAPTMEN1KMT2A
SCHEMBL2469567 0.83 MET (0.67) METMEN1KMT2A
SCHEMBL2472096 0.82 MET (0.56) METMAPTMEN1KMT2A

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
Send feedback