SCHEMBL9830489

SCHEMBL9830489

CCCCOC(=O)NCC(=O)NC(C)C(=O)NC(C(=O)O)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
PPARG P37231 2/20 0.41
PPARA Q07869 1/20 0.41
PLA2G2A P14555 1/20 0.40
PLA2G5 P39877 1/20 0.40
ACHE P22303 12/20 0.39
MAPT P10636 1/20 0.39
HSD17B10 Q99714 1/20 0.39
BIRC2 Q13490 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
SCHEMBL9830496 1.00 SMN1; SMN2 (0.44) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5
SCHEMBL9828991 0.91 SMN1; SMN2 (0.49) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5
SCHEMBL9828998 0.91 SMN1; SMN2 (0.49) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5
SCHEMBL9828719 0.85 ACHE (0.46) SMN1; SMN2ACHE
SCHEMBL9828723 0.85 ACHE (0.46) SMN1; SMN2ACHE
SCHEMBL10481483 0.80 SMN1; SMN2 (0.48) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5
SCHEMBL10481485 0.80 SMN1; SMN2 (0.48) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5
SCHEMBL509967 0.79 SMN1; SMN2 (0.53) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5
SCHEMBL1287155 0.79 SMN1; SMN2 (0.53) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5
SCHEMBL7755148 0.79 SMN1; SMN2 (0.53) SMN1; SMN2PPARGPPARAPLA2G2APLA2G5

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0226304-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1991-08-28 EP disclosed
US-4757066-A Reduces renal toxicity SANKYO COMPANY LIMITED (JP) 1988-07-12 US disclosed
EP-0226304-A1 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1987-06-24 EP disclosed