SCHEMBL7721700

SCHEMBL7721700

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

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ELANE P08246 7/20 0.42
POLB P06746 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.34
ACACB O00763 2/20 0.33
CA2 P00918 1/20 0.33
PRTN3 P24158 2/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MMP1 P03956 1/20 0.30
MMP2 P08253 1/20 0.30
MMP13 P45452 1/20 0.30

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
SCHEMBL7722389 0.91 ELANE (0.50) ELANEPOLBMAPTPKMTDP1
SCHEMBL7721780 0.88 MAPT (0.50) ELANEPOLBMAPTPKMSMN1; SMN2
SCHEMBL7722348 0.88 ELANE (0.42) ELANEPOLBMAPTPKMTDP1
SCHEMBL7722388 0.87 ELANE (0.44) ELANEPOLBMAPTPKMTDP1
SCHEMBL7724552 0.86 ELANE (0.45) ELANEPOLBMAPTPKMTDP1
SCHEMBL7721775 0.86 ELANE (0.51) ELANEPOLBMAPTPKMTDP1
SCHEMBL7720726 0.85 ELANE (0.44) ELANEPOLBMAPTPKMTDP1
SCHEMBL7717464 0.84 ELANE (0.46) ELANEPOLBMAPTPKMTDP1
SCHEMBL7720748 0.82 KMT2A (0.41) ELANEPOLBMAPTPKMSMN1; SMN2
SCHEMBL7721774 0.80 ELANE (0.38) ELANEPOLBMAPTPKMTDP1

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-6395446-B1 CONTAINING SULFONYLDIAZOMETHANE COMPOUND AS ACID GENERATOR SHIN-ETSU CHEMICAL CO., LTD. (JP) 2002-05-28 US disclosed