SCHEMBL28633753

SCHEMBL28633753

C=C(C)C(=O)Oc1cccc2c1C(=O)NC2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.50
ALDH1A1 P00352 3/20 0.50
HPGD P15428 2/20 0.50
GAA P10253 1/20 0.50
HSD17B10 Q99714 1/20 0.50
CASP3 P42574 8/20 0.44
ELANE P08246 2/20 0.38
CASP7 P55210 2/20 0.38
CASP2 P42575 1/20 0.38
CASP6 P55212 1/20 0.38
CASP8 Q14790 1/20 0.38
TTR P02766 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
ABCC4 O15439 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
HSP90AA1 P07900 1/20 0.37
CHRM2 P08172 1/20 0.37

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
SCHEMBL6634972 0.86 KDM4E (0.54) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL9735524 0.81 KDM4E (0.41) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL27513696 0.81 KDM4E (0.39) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL2177078 0.80 KDM4E (0.46) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL7645289 0.79 TYMS (0.46) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL28326979 0.79 ALDH1A1 (0.47) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL8094143 0.79 KDM4E (0.47) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL9768590 0.79 KDM4E (0.51) KDM4EALDH1A1HPGDGAAHSD17B10
SCHEMBL29117714 0.78 ELANE (0.45) KDM4EALDH1A1HPGDHSD17B10CASP3
SCHEMBL8622400 0.77 TTR (0.56) KDM4EALDH1A1HPGDCASP3ELANE

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-113264824-A Method for preparing oxalyl chloride by using phosgene 重庆深润生物医药科技有限公司 2021-08-17 CN disclosed