SCHEMBL7697001

SCHEMBL7697001

CCS(=O)(=O)Oc1ccc(S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2CCCCC2)cc1

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ENPP3 O14638 9/20 0.47
ENPP1 P22413 8/20 0.47
ENPP2 Q13822 6/20 0.47
MMP2 P08253 5/20 0.42
MMP9 P14780 5/20 0.42
MMP14 P50281 5/20 0.42
MMP7 P09237 2/20 0.42
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.36
GAA P10253 1/20 0.36
KMT2A Q03164 1/20 0.34
GLA P06280 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL7691171 0.90 ENPP3 (0.46) ENPP3ENPP1ENPP2MMP2MMP9
SCHEMBL7695999 0.88 ENPP3 (0.45) ENPP3ENPP1ENPP2MMP2MMP9
SCHEMBL7691181 0.86 MMP2 (0.43) ENPP3ENPP1ENPP2MMP2MMP9
SCHEMBL3175601 0.85 MMP1 (0.45) MMP2MMP9MMP7ALDH1A1GAA
SCHEMBL7690154 0.84 MMP2 (0.46) ENPP3ENPP1ENPP2MMP2MMP9
SCHEMBL7721693 0.83 KMT2A (0.39) ENPP3ENPP1ENPP2MMP2MMP9
SCHEMBL3169804 0.83 MMP13 (0.46) MMP2MMP9MMP7ALDH1A1GAA
SCHEMBL7721708 0.81 MAPT (0.47) MMP9ALDH1A1LMNAKMT2AGLA
SCHEMBL6736211 0.81 TSHR (0.44) ALDH1A1LMNAGAA
SCHEMBL6739607 0.81 TSHR (0.44) ALDH1A1LMNAGAA

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