SCHEMBL9640642

SCHEMBL9640642

Nc1ccc(S(=O)(=O)O)c2c(I)cc(N=Nc3ccc(-c4ccc(N=Nc5cc(I)c6c(S(=O)(=O)O)ccc(N)c6c5O)cc4S(=O)(=O)O)c(S(=O)(=O)O)c3)c(O)c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.43
SENP2 Q9HC62 9/20 0.42
SENP1 Q9P0U3 8/20 0.42
SUMO2 P61956 6/20 0.42
SUMO1 P63165 6/20 0.42
SENP7 Q9BQF6 6/20 0.42
SENP3 Q9H4L4 5/20 0.42
MEN1 O00255 2/20 0.39
ALDH1A1 P00352 2/20 0.39
APP P05067 2/20 0.39
MAPT P10636 2/20 0.39
THRB P10828 2/20 0.39
HPGD P15428 2/20 0.39
SNCA P37840 2/20 0.39
RECQL P46063 2/20 0.39
BLM P54132 2/20 0.39
KMT2A Q03164 2/20 0.39
ALOX12 P18054 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
SLC7A11 Q9UPY5 3/20 0.38

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
SCHEMBL9640627 1.00 CYP1A2 (0.43) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9639365 0.88 MEN1 (0.51) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9639346 0.88 MEN1 (0.51) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9640088 0.81 CYP1A2 (0.56) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9640108 0.81 CYP1A2 (0.56) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9639769 0.80 MEN1 (0.45) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9640735 0.80 ALDH1A1 (0.61) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9639756 0.80 MEN1 (0.45) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9640709 0.80 ALDH1A1 (0.61) CYP1A2SENP2SENP1SUMO2SUMO1
SCHEMBL9640501 0.79 KMT2A (0.44) CYP1A2SENP2SENP1SUMO2SUMO1

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 4 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-5008099-A Amyloidosis and Alzheimer's disease diagnostic assay and reagents therefor SALUTAR, INC. (US) 1991-04-16 US disclosed
US-4933156-A Amyloidosis and Alzheimer's disease diagnostic assay and reagents therefor SALUTAR, INC. (US) 1990-06-12 US disclosed