SCHEMBL20903255

SCHEMBL20903255

CNNC(=O)CC(CC(=O)NNC)C(=O)NNC

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
KDM5C P41229 1/20 0.43
EGLN1 Q9GZT9 1/20 0.43
PHF8 Q9UPP1 1/20 0.43
KDM2A Q9Y2K7 1/20 0.43
BMP1 P13497 2/20 0.34
MMP2 P08253 3/20 0.33
MMP9 P14780 3/20 0.33
MMP8 P22894 2/20 0.33
MMP1 P03956 2/20 0.30
MMP3 P08254 2/20 0.30
MMP13 P45452 1/20 0.30
MMP14 P50281 1/20 0.30
ADAM17 P78536 1/20 0.30
USP2 O75604 1/20 0.30
TSHR P16473 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
SCHEMBL7950812 0.75
SCHEMBL12935841 0.75 BMP1 (0.43) BMP1MMP2MMP9MMP8MMP1
SCHEMBL2500295 0.70 KDM4E (0.57) KDM4EKDM5CEGLN1PHF8KDM2A
SCHEMBL23180523 0.70 KDM4E (0.46) KDM4EKDM5CEGLN1PHF8KDM2A
SCHEMBL18756717 0.70 KDM4E (0.41) KDM4EKDM5CEGLN1PHF8KDM2A
SCHEMBL12213974 0.67 KDM4E (0.43) KDM4EKDM5CEGLN1PHF8KDM2A
SCHEMBL6773592 0.66
SCHEMBL2242250 0.66
SCHEMBL4553950 0.66
SCHEMBL12725535 0.66

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
EP-3470135-A1 A COMPOSITION COMPRISING SOLVENT AND HEAT RESISTANT CAPSULES AGFA NV (BE) 2019-04-17 EP disclosed