SCHEMBL9640449

SCHEMBL9640449

Nc1ccc(S(=O)(=O)O)c2ccc(/N=N/c3ccc(-c4ccc(/N=N/c5ccc6c(S(=O)(=O)O)ccc(N)c6c5O)cc4)cc3)c(O)c12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 3/20 0.59
HSD17B10 Q99714 4/20 0.55
CYP2C9 P11712 3/20 0.55
CYP2C19 P33261 3/20 0.55
MEN1 O00255 4/20 0.54
THRB P10828 4/20 0.54
HPGD P15428 4/20 0.54
RECQL P46063 4/20 0.54
KMT2A Q03164 4/20 0.54
ALDH1A1 P00352 3/20 0.54
MAPT P10636 3/20 0.54
BLM P54132 3/20 0.54
KDM4E B2RXH2 3/20 0.54
CYP3A4 P08684 3/20 0.54
MAPK1 P28482 3/20 0.54
APP P05067 2/20 0.54
SNCA P37840 2/20 0.54
TP53 P04637 2/20 0.54
ALOX15 P16050 2/20 0.54
BRCA1 P38398 2/20 0.54

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
SCHEMBL9640482 1.00 CYP1A2 (0.59) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL28747674 0.92 CYP1A2 (0.59) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL29702447 0.92 CYP1A2 (0.59) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL9640497 0.90 CYP1A2 (0.57) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL28747688 0.87 CYP1A2 (0.54) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL9640108 0.86 CYP1A2 (0.56) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL9640088 0.86 CYP1A2 (0.56) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL9640818 0.85 HSD17B10 (0.75) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL9640864 0.85 MEN1 (0.56) CYP1A2HSD17B10CYP2C9CYP2C19MEN1
SCHEMBL9640845 0.85 MEN1 (0.56) CYP1A2HSD17B10CYP2C9CYP2C19MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0287909-B1 AMYLOIDOSIS AND ALZHEIMER'S DISEASE DIAGNOSTIC ASSAY AND REAGENTS THEREFOR SALUTAR, INC. (US) 1992-09-02 EP disclosed
US-5039511-A Amyloidosis and alzheimer's disease diagnostic assay and reagents therefor SALUTAR, INC. (US) 1991-08-13 US disclosed
US-4933156-A Amyloidosis and Alzheimer's disease diagnostic assay and reagents therefor SALUTAR, INC. (US) 1990-06-12 US disclosed