SCHEMBL7470544

SCHEMBL7470544

CCC1CSC(OC(=O)OC)C1=O

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 1/20 0.33
MMP9 P14780 1/20 0.33
MMP14 P50281 1/20 0.33
CYP1A2 P05177 1/20 0.31
HIF1A Q16665 1/20 0.31

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
SCHEMBL7467616 0.86 MMP2 (0.36) MMP2MMP9MMP14
SCHEMBL7476315 0.86 ALDH1A1 (0.36) MMP2MMP9MMP14
SCHEMBL7469762 0.80 MMP2 (0.31) MMP2MMP9MMP14
SCHEMBL7469088 0.78 CYP1A2 (0.33) CYP1A2HIF1A
SCHEMBL7472185 0.77 CYP1A2 (0.33) CYP1A2HIF1A
SCHEMBL7026744 0.73 KMT2A (0.35) CYP1A2HIF1A
SCHEMBL7471984 0.73 CYP1A2 (0.30) CYP1A2HIF1A
SCHEMBL7467685 0.68 ALDH1A1 (0.38) MMP2MMP9MMP14
SCHEMBL7029250 0.67 ALDH1A1 (0.31)
SCHEMBL7464039 0.67 MMP2 (0.34) MMP2MMP9MMP14

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0859774-B1 SUBSTITUTED SULPHONYLAMINO (THIO)CARBONYL COMPOUNDS AS HERBICIDES BAYER AG (DE) 2002-04-03 EP disclosed
EP-0859774-A1 SUBSTITUTED SULPHONYLAMINO (THIO)CARBONYL COMPOUNDS AS HERBICIDES BAYER AG (DE) 1998-08-26 EP disclosed