SCHEMBL7721708

SCHEMBL7721708

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

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.47
POLB P06746 3/20 0.47
PKM P14618 1/20 0.47
ESR1 P03372 1/20 0.38
PGR P06401 1/20 0.38
CHRM2 P08172 1/20 0.38
ADORA3 P0DMS8 1/20 0.38
AR P10275 1/20 0.38
CHRM1 P11229 1/20 0.38
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38
PTGS2 P35354 3/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 2/20 0.36
HSD17B10 Q99714 1/20 0.36
KMT2A Q03164 3/20 0.35
ALDH1A1 P00352 1/20 0.35
GFER P55789 1/20 0.34
MEN1 O00255 2/20 0.34
TTR P02766 1/20 0.34

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
SCHEMBL7721781 0.89 ELANE (0.40) MAPTPOLBPKMHSD17B10GLA
SCHEMBL7721693 0.87 KMT2A (0.39) MAPTPOLBESR1LMNAKDM4E
SCHEMBL3175601 0.86 MMP1 (0.45) POLBPKMCHRM2CHRM1KDM4E
SCHEMBL7724564 0.85 MAPT (0.56) MAPTPOLBPKMPTGS2LMNA
SCHEMBL3169804 0.84 MMP13 (0.46) POLBPKMKDM4EKMT2AALDH1A1
SCHEMBL384384 0.84 MAPT (0.61) MAPTPOLBPKMPTGS2LMNA
SCHEMBL7695999 0.84 ENPP3 (0.45) LMNAALDH1A1GLAMMP1MMP9
SCHEMBL7697001 0.81 ENPP3 (0.47) POLBLMNAKMT2AALDH1A1GLA
SCHEMBL563060 0.81 ALDH1A1 (0.44) MAPTPOLBADORA3LMNAKDM4E
SCHEMBL3166504 0.80 MMP9 (0.45) POLBPTGS2KDM4EKMT2AALDH1A1

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