SCHEMBL9803208

SCHEMBL9803208

CCCNC(=CCC(=O)O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
EPHX1 P07099 1/20 0.35
MCL1 Q07820 1/20 0.34
KDM4E B2RXH2 2/20 0.34
TDP1 Q9NUW8 1/20 0.34

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
SCHEMBL9803201 1.00 MMP1 (0.36) MMP1MMP2MMP3MMP9KDM4C
SCHEMBL9803199 0.89 EPHX1 (0.42) MMP2EPHX1
SCHEMBL9803202 0.89 EPHX1 (0.42) MMP2EPHX1
SCHEMBL27786770 0.74 MMP1 (0.35) MMP1MMP2MMP3MMP9KDM4C
SCHEMBL4950431 0.72 ALOX15 (0.36) MMP1MMP2MMP3MMP9KDM4C
SCHEMBL5693362 0.71 GRIK1 (0.39)
SCHEMBL22991290 0.67 MMP1 (0.39) MMP1MMP2MMP3MMP9KDM4C
SCHEMBL7413171 0.67 EPHX1 (0.48) MMP2EPHX1
SCHEMBL7413162 0.67 EPHX1 (0.48) MMP2EPHX1
SCHEMBL583601 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-0181312-B1 PROCESS FOR PREPARATION OF SUBSTITUTED PYRIDINES Monsanto Company (US) 1991-04-03 EP disclosed