SCHEMBL21362414

SCHEMBL21362414

CC(=O)NOCC(=O)N(C)C

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 3/20 0.33
CYP1A2 P05177 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 2/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 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
SCHEMBL9620253 0.73
SCHEMBL37673 0.72
SCHEMBL1562493 0.70
SCHEMBL9620243 0.70
SCHEMBL1258611 0.69 ALDH1A1 (0.42) SMN1; SMN2ALDH1A1CYP1A2L3MBTL1KDM4E
SCHEMBL10621262 0.69 ALDH1A1 (0.50) SMN1; SMN2ALDH1A1CYP1A2L3MBTL1KDM4E
SCHEMBL16789173 0.68 MAPK1 (0.35) SMN1; SMN2ALDH1A1
SCHEMBL4607278 0.68 CHRM2 (0.45) SMN1; SMN2ALDH1A1CYP1A2
SCHEMBL49014 0.67
SCHEMBL25702185 0.67

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
EP-2857401-B1 NOVEL -LACTAMASE INHIBITOR AND METHOD FOR PRODUCING SAME MEIJI SEIKA PHARMA CO LTD (JP) 2019-09-18 EP disclosed