SCHEMBL28877233

SCHEMBL28877233

NC(=O)C(CC(=O)O)CC(CC(=O)O)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.44
SLC22A6 Q4U2R8 1/20 0.43
GABRR1 P24046 2/20 0.42
LMNA P02545 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
CACNA2D1 P54289 2/20 0.39
CACNB3 P54284 1/20 0.39
CACNA1C Q13936 1/20 0.39
PGR P06401 1/20 0.39
ADRA1A P35348 1/20 0.39
HTR2B P41595 1/20 0.39
CACNA2D2 Q9NY47 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CPA1 P15085 2/20 0.37
CPB1 P15086 1/20 0.37
CPA3 P15088 1/20 0.37
CPB2 Q96IY4 1/20 0.37
CA1 P00915 1/20 0.36
CA2 P00918 1/20 0.36
GLRA1 P23415 1/20 0.35

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
SCHEMBL9157043 0.91 FOLH1 (0.46) FOLH1SLC22A6GABRR1LMNATDP1
SCHEMBL10000212 0.88 CACNA2D1 (0.52) FOLH1CACNA2D1CACNB3CACNA1CPGR
SCHEMBL7094095 0.88 CACNA2D1 (0.52) FOLH1CACNA2D1CACNB3CACNA1CPGR
SCHEMBL27605919 0.83 FOLH1 (0.41) FOLH1SLC22A6GABRR1LMNATDP1
SCHEMBL2484598 0.79 FOLH1 (0.43) FOLH1SLC22A6GABRR1LMNATDP1
SCHEMBL28601320 0.79 CA1 (0.37) LMNATDP1CA1CA2
SCHEMBL28005924 0.78 CHRM1 (0.52) FOLH1TDP1ADRA1ACA1CA2
SCHEMBL9976627 0.76 FOLH1 (0.35) FOLH1SLC22A6GABRR1LMNATDP1
SCHEMBL10479816 0.76 GRIK1 (0.47) FOLH1SLC22A6GABRR1LMNATDP1
SCHEMBL28836719 0.76 FOLH1 (0.50) FOLH1SLC22A6GABRR1LMNACA1

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-113227337-B Lubricant composition for ball joints 国际壳牌研究有限公司 2022-10-04 CN disclosed