SCHEMBL7695885

SCHEMBL7695885

CC(C)(C)Oc1ccc(C(=O)C(=[N+]=[N-])S(=O)(=O)c2ccc(OS(C)(=O)=O)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 2/20 0.37
MMP7 P09237 2/20 0.37
MMP9 P14780 2/20 0.37
MMP14 P50281 2/20 0.37
MMP1 P03956 1/20 0.37
MMP3 P08254 1/20 0.35
MMP8 P22894 1/20 0.35
ALDH1A1 P00352 2/20 0.34
CYP11B1 P15538 3/20 0.34
CYP11B2 P19099 3/20 0.34
ABL1 P00519 2/20 0.32
EGFR P00533 2/20 0.32
PTPN1 P18031 1/20 0.32
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
RAB9A P51151 2/20 0.32
STS P08842 2/20 0.31
ENPP3 O14638 2/20 0.31
ENPP1 P22413 2/20 0.31
SMN1; SMN2 Q16637 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 0.88 MMP2 (0.40) MMP2MMP7MMP9MMP14CYP11B1
SCHEMBL7690693 0.88 ENPP1 (0.42) MMP2MMP7MMP9MMP14MMP1
SCHEMBL7697548 0.86 MMP2 (0.39) MMP2MMP7MMP9MMP14MMP1
SCHEMBL7721785 0.86 MAPT (0.44) ALDH1A1CYP11B1CYP11B2KMT2AMEN1
SCHEMBL7695453 0.85 MMP2 (0.40) MMP2MMP7MMP9MMP14MMP1
SCHEMBL7696010 0.84 MMP2 (0.37) MMP2MMP7MMP9MMP14MMP1
SCHEMBL7720726 0.83 ELANE (0.44) MMP2MMP9MMP14CYP11B1CYP11B2
SCHEMBL7721776 0.83 KMT2A (0.43) ALDH1A1CYP11B1CYP11B2KMT2AMEN1
SCHEMBL7689322 0.82 ALDH1A1 (0.38) MMP2MMP7MMP9MMP14MMP1
SCHEMBL6742537 0.80 TSHR (0.46) MMP2MMP14MMP1CA12CA1

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