SCHEMBL7722372

SCHEMBL7722372

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

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
ESR1 P03372 2/20 0.49
HIF1A Q16665 2/20 0.49
RECQL P46063 1/20 0.49
ELANE P08246 2/20 0.45
MAPT P10636 4/20 0.40
POLB P06746 1/20 0.40
PKM P14618 1/20 0.40
ACHE P22303 2/20 0.39
RAB9A P51151 3/20 0.39
NPC1 O15118 2/20 0.39
LMNA P02545 2/20 0.38
HTT P42858 2/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD17B10 Q99714 1/20 0.38
NFKB1 P19838 1/20 0.37
NFKB2 Q00653 1/20 0.37
RELA Q04206 1/20 0.37
BCL9 O00512 1/20 0.37

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
SCHEMBL7724577 0.94 ELANE (0.51) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7724562 0.94 KMT2A (0.51) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7720748 0.91 KMT2A (0.41) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7721784 0.91 KMT2A (0.41) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7717473 0.90 KMT2A (0.43) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7722375 0.88 BCL9 (0.51) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7720645 0.87 KMT2A (0.41) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7721800 0.86 KMT2A (0.45) KMT2ASMN1; SMN2RECQLELANEMAPT
SCHEMBL7721693 0.85 KMT2A (0.39) KMT2ASMN1; SMN2ESR1HIF1ARECQL
SCHEMBL7717475 0.84 KMT2A (0.45) 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