SCHEMBL8466581

SCHEMBL8466581

CCCCCOC(=O)N[C@H](C(=O)O)C(C)C

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.55
PLA2G2A P14555 1/20 0.54
PLA2G5 P39877 1/20 0.54
PPARG P37231 2/20 0.53
PPARA Q07869 1/20 0.53
EPHX1 P07099 1/20 0.51
ACHE P22303 6/20 0.46
TP53 P04637 1/20 0.46
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
LMNA P02545 1/20 0.43
GAA P10253 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
SCHEMBL8467616 1.00 SMN1; SMN2 (0.55) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL9828390 1.00 SMN1; SMN2 (0.55) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7771209 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7765623 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7769016 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7770755 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7770749 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7769533 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7770760 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA
SCHEMBL7770751 0.98 PLA2G2A (0.56) SMN1; SMN2PLA2G2APLA2G5PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5994361-A ANTITUMOR, ANTICANCER AGENT BIOCHEM PHARMA (CA) 1999-11-30 US disclosed
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