SCHEMBL28108463

SCHEMBL28108463

CCCOC(=O)N1C(=O)CC(Br)C1=O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
GLA P06280 1/20 0.36
ALDH1A1 P00352 4/20 0.33
BCHE P06276 1/20 0.32
CNR2 P34972 1/20 0.31
LMNA P02545 1/20 0.30
HSP90AA1 P07900 1/20 0.30
POLB P06746 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
SCHEMBL11043941 0.89 ALDH1A1 (0.36) KDM4EGLAALDH1A1BCHE
SCHEMBL28108459 0.78 FAAH (0.33) LMNA
SCHEMBL18485434 0.74 ALDH1A1 (0.39) KDM4EGLAALDH1A1BCHECNR2
SCHEMBL18485427 0.71 HTT (0.41) KDM4EGLAALDH1A1LMNAPOLB
SCHEMBL18485469 0.70 LMNA (0.40) KDM4EGLAALDH1A1LMNA
SCHEMBL13642348 0.70 GBA2 (0.34) BCHE
Bromide SCHEMBL11043936 0.68 ALDH1A1 (0.42) KDM4EALDH1A1BCHE
SCHEMBL17935458 0.68 GBA2 (0.30)
SCHEMBL18485436 0.67 ALDH1A1 (0.44) KDM4EGLAALDH1A1BCHELMNA
SCHEMBL18485410 0.67 ALDH1A1 (0.53) ALDH1A1LMNAPOLB

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
CN-106133984-A Addition agent of non-aqueous electrolyte, nonaqueous electrolytic solution and electrical storage device 住友精化株式会社 2016-11-16 CN disclosed