SCHEMBL7721776

SCHEMBL7721776

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

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.43
SMN1; SMN2 Q16637 3/20 0.43
ESR1 P03372 2/20 0.43
HIF1A Q16665 2/20 0.43
RECQL P46063 1/20 0.43
ELANE P08246 4/20 0.40
MAPT P10636 3/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
CYP11B1 P15538 3/20 0.34
CYP11B2 P19099 3/20 0.34
LMNA P02545 1/20 0.33
PTGS2 P35354 1/20 0.33
MEN1 O00255 1/20 0.32
HTT P42858 1/20 0.32
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL7722379 0.89 KMT2A (0.43) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7722368 0.87 KMT2A (0.49) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7721785 0.87 MAPT (0.44) KMT2AESR1ELANEMAPTCYP11B1
SCHEMBL7721805 0.86 ELANE (0.53) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7690054 0.85 MMP2 (0.40) KMT2ASMN1; SMN2RAB9ACYP11B1CYP11B2
SCHEMBL7720748 0.85 KMT2A (0.41) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7720726 0.84 ELANE (0.44) SMN1; SMN2ELANEMAPTCYP11B1CYP11B2
SCHEMBL7695885 0.83 MMP2 (0.37) KMT2ASMN1; SMN2ELANERAB9ACYP11B1
SCHEMBL6742537 0.82 TSHR (0.46)
SCHEMBL7720754 0.81 KMT2A (0.42) KMT2ASMN1; SMN2ESR1HIF1ARECQL

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