SCHEMBL805129

SCHEMBL805129

CCC(C)(C)C(CNC(=O)CCC(=O)O)CC(C)(C)C

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PHF8 Q9UPP1 5/20 0.34
KDM2A Q9Y2K7 5/20 0.34
KDM4E B2RXH2 3/20 0.34
KDM5C P41229 3/20 0.34
EGLN1 Q9GZT9 2/20 0.34
HTT P42858 2/20 0.34
KDM6B O15054 1/20 0.33
FOLH1 Q04609 1/20 0.33
KDM7A Q6ZMT4 1/20 0.33
MME P08473 1/20 0.30
CYP2C19 P33261 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
SCHEMBL13975598 0.76 TSHR (0.38) FOLH1
SCHEMBL8808571 0.72 SLC22A6 (0.32)
SCHEMBL10076039 0.70 ALDH1A1 (0.30)
SCHEMBL14560931 0.70 KDM4E (0.32) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL7094098 0.68 CYP2D6 (0.56) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL18652185 0.68 PHF8 (0.46) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL799421 0.67 PHF8 (0.42) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL12927111 0.65 SIGMAR1 (0.46) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL3968787 0.65 FAAH (0.54) PHF8KDM2AKDM4EKDM5CEGLN1
SCHEMBL14560932 0.65 PHF8 (0.39) PHF8KDM2AKDM4EKDM5CEGLN1

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
US-20120069084-A1 INK COMPOSITION, INK SET AND IMAGE FORMING METHOD FUJIFILM CORPORATION (JP) 2012-03-22 US disclosed