SCHEMBL8867022

SCHEMBL8867022

CC(=O)NNC(=O)Nc1cccc(C=CC[O])c1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 9/20 0.46
MMP2 P08253 9/20 0.46
MMP9 P14780 9/20 0.46
MAOB P27338 7/20 0.46
MAOA P21397 4/20 0.46
EGFR P00533 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CYP1A2 P05177 1/20 0.42
HSD17B10 Q99714 1/20 0.42
MAPT P10636 1/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL8867015 1.00 MMP1 (0.46) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867682 0.85 MAOB (0.46) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867679 0.85 MAOB (0.46) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867610 0.84 MMP1 (0.47) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867605 0.84 MMP1 (0.47) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867677 0.83 PKM (0.55) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867672 0.83 PKM (0.55) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867284 0.83 MAOB (0.53) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8867288 0.83 MAOB (0.53) MMP1MMP2MMP9MAOBMAOA
SCHEMBL8866959 0.82 MAPT (0.46) MAOBMAOAMAPT

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-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 US disclosed