SCHEMBL7697516

SCHEMBL7697516

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 3/20 0.42
MMP9 P14780 3/20 0.42
MMP14 P50281 3/20 0.42
MMP7 P09237 2/20 0.42
ALDH1A1 P00352 4/20 0.40
MAPT P10636 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
ENPP1 P22413 2/20 0.39
KMT2A Q03164 3/20 0.39
GAA P10253 2/20 0.38
ENPP2 Q13822 2/20 0.37
ENPP3 O14638 1/20 0.37
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
STS P08842 1/20 0.36
PKM P14618 1/20 0.36
CES2 O00748 1/20 0.36

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
SCHEMBL7690055 0.90 MMP2 (0.39) MMP2MMP9MMP14MMP7ALDH1A1
SCHEMBL7696242 0.89 MMP2 (0.43) MMP2MMP9MMP14MMP7ALDH1A1
SCHEMBL7697548 0.88 MMP2 (0.39) MMP2MMP9MMP14MMP7ALDH1A1
SCHEMBL7696064 0.87 ENPP1 (0.41) MMP2MMP9MMP14MMP7ALDH1A1
SCHEMBL7690054 0.87 MMP2 (0.40) MMP2MMP9MMP14MMP7ENPP1
SCHEMBL7693046 0.86 MMP2 (0.39) MMP2MMP9MMP14MMP7ALDH1A1
SCHEMBL9010795 0.85 CES2 (0.48) ALDH1A1MAPTKMT2AGAAHPGD
SCHEMBL9010786 0.85 ALDH1A1 (0.52) ALDH1A1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL7722368 0.84 KMT2A (0.49) ALDH1A1MAPTCYP1A2CYP3A4CYP2C9
SCHEMBL7722385 0.82 LMNA (0.51) ALDH1A1MAPTCYP1A2CYP3A4CYP2C9

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