SCHEMBL7720748

SCHEMBL7720748

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
ESR1 P03372 2/20 0.41
HIF1A Q16665 2/20 0.41
RECQL P46063 1/20 0.41
ELANE P08246 5/20 0.39
MAPT P10636 3/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
LMNA P02545 1/20 0.36
BCL9 O00512 1/20 0.35
CTNNB1 P35222 1/20 0.35
ACHE P22303 2/20 0.34
POLB P06746 1/20 0.34
PKM P14618 1/20 0.34
PRTN3 P24158 1/20 0.34
NFKB1 P19838 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL7722372 0.91 KMT2A (0.49) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7721784 0.88 KMT2A (0.41) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7717473 0.87 KMT2A (0.43) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7724562 0.86 KMT2A (0.51) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7724577 0.86 ELANE (0.51) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7721780 0.86 MAPT (0.50) KMT2ASMN1; SMN2ELANEMAPTLMNA
SCHEMBL7721776 0.85 KMT2A (0.43) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7721700 0.82 ELANE (0.42) SMN1; SMN2ELANEMAPTPOLBPKM
SCHEMBL7695981 0.82 MMP2 (0.39) SMN1; SMN2ELANERAB9AALDH1A1GAA
SCHEMBL7720645 0.81 KMT2A (0.41) 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