SCHEMBL9600683

SCHEMBL9600683

CCCCCN1CCN([C]=O)C(=O)C1=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.40
GBA1 P04062 1/20 0.36
BCHE P06276 1/20 0.36
ACHE P22303 1/20 0.36
ALDH1A1 P00352 6/20 0.35
ALOX5 P09917 2/20 0.35
PTGS1 P23219 3/20 0.34
PTGS2 P35354 3/20 0.34
MGLL Q99685 3/20 0.34
FAAH O00519 2/20 0.34
NPC1 O15118 3/20 0.34
RAB9A P51151 3/20 0.34
KDM4E B2RXH2 2/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
HSD17B10 Q99714 2/20 0.34
TSHR P16473 1/20 0.34
GRM5 P41594 1/20 0.34
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33

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
SCHEMBL9600835 0.98 PLA2G2A (0.41) PLA2G2AGBA1BCHEACHEALDH1A1
SCHEMBL9600708 0.95 ALDH1A1 (0.38) PLA2G2AGBA1BCHEACHEALDH1A1
SCHEMBL9600392 0.87 L3MBTL1 (0.38) BCHEACHEGRM5
SCHEMBL4018142 0.80 GAA (0.39) SMN1; SMN2GAAALOX15
SCHEMBL4421172 0.73 GBA1 (0.44) GBA1BCHEACHEALDH1A1ALOX5
SCHEMBL9600689 0.72 PLA2G2A (0.42) PLA2G2AGBA1BCHEACHEALDH1A1
SCHEMBL9769185 0.71 GBA1 (0.47) PLA2G2AGBA1BCHEACHEALDH1A1
SCHEMBL31093212 0.71 GBA1 (0.47) PLA2G2AGBA1BCHEACHEALDH1A1
SCHEMBL31093244 0.71 GBA1 (0.47) PLA2G2AGBA1BCHEACHEALDH1A1
SCHEMBL9617015 0.71 GBA1 (0.47) PLA2G2AGBA1BCHEACHEALDH1A1

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-0215435-B1 2-OXA-ISOCEPHEM COMPOUNDS, COMPOSITIONS CONTAINING SAME AND PROCESSES FOR PREPARING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-03-03 EP disclosed
US-4831026-A ANTIBIOTICS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1989-05-16 US disclosed
EP-0215435-A1 2-Oxa-isocephem compounds, compositions containing same and processes for preparing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-03-25 EP disclosed