SCHEMBL9602857

SCHEMBL9602857

CC(C)N1CCN([C]=O)C(=O)C1=O

nearest known ligand 0.30

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
GRM5 P41594 1/20 0.30

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
SCHEMBL22017463 0.82 ALDH1A1 (0.37) ALDH1A1GRM5
SCHEMBL9602149 0.71 BRD4 (0.31)
SCHEMBL12890580 0.71 PIK3CD (0.35) ALDH1A1GRM5
SCHEMBL9602860 0.67 SMN1; SMN2 (0.37) ALDH1A1
SCHEMBL22017935 0.67 GAA (0.39) ALDH1A1
SCHEMBL18792809 0.67 PIK3CD (0.32) ALDH1A1
SCHEMBL4018142 0.67 GAA (0.39)
SCHEMBL596921 0.66 PER2 (0.38) ALDH1A1
SCHEMBL22017702 0.65 IL4I1 (0.42)
SCHEMBL22017741 0.65 PIK3CD (0.46)

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