SCHEMBL22310461

SCHEMBL22310461

CC(CNC(=O)CCC(=O)O)NC(=O)CCC(=O)O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PHF8 Q9UPP1 5/20 0.42
KDM2A Q9Y2K7 5/20 0.42
KDM4E B2RXH2 3/20 0.42
KDM5C P41229 3/20 0.42
EGLN1 Q9GZT9 3/20 0.42
KDM6B O15054 1/20 0.41
FOLH1 Q04609 1/20 0.41
KDM7A Q6ZMT4 1/20 0.41
EPHX2 P34913 1/20 0.41
ALDH1A1 P00352 1/20 0.39
GNPAT O15228 1/20 0.39
HPGD P15428 1/20 0.37
HTT P42858 2/20 0.36
ITGB3 P05106 1/20 0.36
ITGA2B P08514 1/20 0.36
LMNA P02545 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
SUCNR1 Q9BXA5 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL7094098 0.81 CYP2D6 (0.56) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL799655 0.79 SMN1; SMN2 (0.53) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL13458546 0.79 SMN1; SMN2 (0.53) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL11043388 0.78 EPHX2 (0.41) EPHX2ALDH1A1HPGDSMN1; SMN2
SCHEMBL23095181 0.78 PLA2G10 (0.46) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL21730954 0.78 POLB (0.54) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL94233 0.76 MEN1 (0.54) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL799421 0.76 PHF8 (0.42) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL23443068 0.76 FAAH (0.65)
SCHEMBL23442042 0.76 FAAH (0.65)

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
WO-2020159436-A1 WATER CHANNEL AND METHOD OF FORMING SAME AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-08-06 WO disclosed