SCHEMBL7696010

SCHEMBL7696010

CCCCS(=O)(=O)Oc1ccc(S(=O)(=O)C(=[N+]=[N-])C(=O)c2ccc(OC(C)(C)C)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 4/20 0.37
MMP9 P14780 4/20 0.37
MMP14 P50281 4/20 0.37
MMP7 P09237 2/20 0.37
STS P08842 13/20 0.35
ALPL P05186 1/20 0.33
ALPI P09923 1/20 0.33
MMP1 P03956 1/20 0.33
JAK1 P23458 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
SCHEMBL7690054 0.91 MMP2 (0.40) MMP2MMP9MMP14MMP7STS
SCHEMBL7696792 0.90 ENPP1 (0.38) MMP2MMP9MMP14MMP7STS
SCHEMBL7690055 0.89 MMP2 (0.39) MMP2MMP9MMP14MMP7STS
SCHEMBL7689349 0.87 CES2 (0.40) MMP2MMP9MMP14MMP7STS
SCHEMBL7696007 0.85 MRGPRX1 (0.35) STSALPLALPI
SCHEMBL7690238 0.85 MMP2 (0.39) MMP2MMP9MMP14MMP7STS
SCHEMBL6742537 0.84 TSHR (0.46) MMP2MMP14MMP1
SCHEMBL7695885 0.84 MMP2 (0.37) MMP2MMP9MMP14MMP7STS
SCHEMBL7694416 0.83 MMP2 (0.39) MMP2MMP9MMP14MMP7STS
SCHEMBL7696771 0.81 MMP2 (0.41) MMP2MMP9MMP14MMP7STS

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-6338931-B1 PHOTOACID GENERATOR OF SULFONYLDIAZOMETHANE COMPOUND SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-01-15 US disclosed