SCHEMBL16720108

SCHEMBL16720108

O=S(=O)(Nc1ccccc1)n1cccc1

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.50
KEAP1 Q14145 3/20 0.50
CA1 P00915 3/20 0.50
IL1RN P18510 1/20 0.48
ERAP1 Q9NZ08 1/20 0.48
KMT2A Q03164 4/20 0.45
PKM P14618 3/20 0.45
MEN1 O00255 3/20 0.45
ALDH1A1 P00352 1/20 0.45
HPGD P15428 1/20 0.44
CA12 O43570 4/20 0.41
CA9 Q16790 4/20 0.41
PGR P06401 2/20 0.38
POLB P06746 1/20 0.38
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL16720612 0.82 ALDH1A1 (0.43) KMT2APKMMEN1ALDH1A1HPGD
SCHEMBL16720523 0.77 HSD17B2 (0.50) KMT2APKMMEN1ALDH1A1HTT
SCHEMBL16720320 0.77 ALDH1A1 (0.47) KMT2APKMMEN1ALDH1A1CA12
SCHEMBL14080961 0.77 KMT2A (0.42) CA2KEAP1CA1IL1RNERAP1
SCHEMBL7839074 0.71 FKBP1A (0.66) KMT2AMEN1ALDH1A1HPGDPOLB
SCHEMBL6005110 0.71 CA2 (0.64) CA2KEAP1CA1IL1RNERAP1
SCHEMBL59151 0.71 KEAP1 (0.64) CA2KEAP1CA1IL1RNERAP1
SCHEMBL2512424 0.69 FKBP1A (0.69) KMT2AMEN1ALDH1A1HPGDGAA
SCHEMBL23141160 0.69 KEAP1 (0.61) CA2KEAP1CA1IL1RNERAP1
SCHEMBL21692802 0.68 CA1 (0.34) CA2CA1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3068758-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE The Wistar Institute Of Anatomy And Biology (US) 2016-09-21 EP disclosed
WO-2015073864-A1 EBNA1 INHIBITORS AND THEIR METHOD OF USE THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) 2015-05-21 WO disclosed