SCHEMBL7109998

SCHEMBL7109998

O=S(=O)(O)Nc1ccc(-c2nc3ccccc3s2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.75
GAA P10253 3/20 0.62
APP P05067 3/20 0.62
GLA P06280 2/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
MMP9 P14780 2/20 0.60
MMP8 P22894 2/20 0.60
MMP2 P08253 1/20 0.60
MMP13 P45452 1/20 0.60
KDM4E B2RXH2 5/20 0.59
RAB9A P51151 5/20 0.59
MAPT P10636 4/20 0.59
ALDH1A1 P00352 4/20 0.59
NPC1 O15118 4/20 0.59
LMNA P02545 1/20 0.59
SMN1; SMN2 Q16637 2/20 0.56
PKM P14618 2/20 0.56
HPGD P15428 2/20 0.56
NFKB1 P19838 1/20 0.56

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
Ammonia Solution, Strong SCHEMBL7106619 0.99 TP53 (0.73) TP53GAAAPPGLAMEN1
SCHEMBL7109439 0.84 TP53 (0.73) TP53GAAAPPGLAMEN1
SCHEMBL7258969 0.81 MAPT (0.74) TP53GAAAPPGLAMEN1
SCHEMBL4780914 0.80 APP (0.77) TP53GAAAPPGLAMEN1
SCHEMBL24155562 0.80 APP (0.76) TP53GAAAPPGLAMEN1
SCHEMBL8397393 0.80 APP (0.76) TP53GAAAPPGLAMEN1
SCHEMBL366824 0.79 RAB9A (0.81) TP53GAAAPPGLAMEN1
SCHEMBL29474819 0.79 RAB9A (0.81) TP53GAAAPPGLAMEN1
SCHEMBL7109795 0.79 TP53 (0.49) TP53MEN1KMT2AKDM4ERAB9A
SCHEMBL3679894 0.79 ALDH1A1 (0.78) TP53GAAAPPGLAMEN1

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-0812319-B9 2-ARYLBENZAZOLE COMPOUNDS CANCER RES VENTURES LTD (GB) 2003-10-08 EP claimed
EP-0812319-B1 2-ARYLBENZAZOLE COMPOUNDS CANCER RES VENTURES LTD (GB) 2002-07-10 EP claimed