SCHEMBL2583259

SCHEMBL2583259

CC(C(=O)c1ccc2nc(-c3ccccc3)oc2c1)N(C(=O)O)C(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
HDAC6 Q9UBN7 5/20 0.47
TTR P02766 1/20 0.45
ALB P02768 1/20 0.45
MAOA P21397 1/20 0.45
CNR1 P21554 1/20 0.45
DRD1 P21728 1/20 0.45
OPRD1 P41143 1/20 0.45
PDE4D Q08499 1/20 0.45
PDE3A Q14432 1/20 0.45
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
MAPT P10636 5/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL2582952 0.84 CASP3 (0.50) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL2591395 0.80 CASP3 (0.55) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL2592274 0.80 CASP3 (0.55) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL2584474 0.78 CASP3 (0.48) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL2582892 0.77 CASP3 (0.52) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL2582895 0.77 CASP3 (0.52) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL14759058 0.77 CASP3 (0.55) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL2583742 0.76 CASP3 (0.53) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL121973 0.76 CASP3 (0.69) CASP3SENP8SENP7SENP6HDAC6
SCHEMBL29784233 0.76 TTR (0.72) CASP3SENP8SENP7SENP6HDAC6

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
WO-2011138427-A2 PYRIDAZINONES AS GPR119 AGONISTS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-10 WO disclosed