SCHEMBL11054319

SCHEMBL11054319

Nc1c(N=Nc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2O)cc(S(=O)(=O)O)c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ APP P05067 2/20 0.58
▸ HPGD P15428 2/20 0.58
▸ ALOX12 P18054 2/20 0.58
▸ MEN1 O00255 1/20 0.58
▸ ALDH1A1 P00352 1/20 0.58
▸ MAPT P10636 1/20 0.58
▸ THRB P10828 1/20 0.58
▸ SNCA P37840 1/20 0.58
▸ RECQL P46063 1/20 0.58
▸ BLM P54132 1/20 0.58
▸ KMT2A Q03164 1/20 0.58
▸ TDP1 Q9NUW8 1/20 0.58
▸ SENP2 Q9HC62 4/20 0.57
▸ SENP1 Q9P0U3 4/20 0.57
▸ SUMO2 P61956 3/20 0.57
▸ SUMO1 P63165 3/20 0.57
▸ SENP7 Q9BQF6 3/20 0.57
▸ SENP3 Q9H4L4 2/20 0.55
▸ SLC7A11 Q9UPY5 5/20 0.55
▸ NT5E P21589 1/20 0.47

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
SCHEMBL19921905 0.84 APP (0.73) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL15606891 0.84 APP (0.73) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL14690686 0.82 APP (0.70) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL10895528 0.81 CYP1A2 (0.59) HPGDALOX12MEN1ALDH1A1MAPT
SCHEMBL15120242 0.80 SENP2 (0.70) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL18044215 0.79 SENP2 (0.62) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL14988444 0.79 SENP2 (0.68) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL15120264 0.79 SENP2 (0.62) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL14988448 0.79 SENP2 (0.68) APPHPGDALOX12MEN1ALDH1A1
SCHEMBL14988450 0.79 SENP2 (0.68) APPHPGDALOX12MEN1ALDH1A1

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
US-4469485-A Use of the 1:2 chromium complex of 1-amino-2-(3', 5'-dinitro-2'-hydroxyphenylazo)-4-sulfonaphthalene and alkali metal salts thereof for dyeing polyamides and oxide layers on aluminum and aluminum alloys SANDOZ LTD. (CH) 1984-09-04 — — US disclosed
US-4416816-A 1:2 Chromium complex of 1-amino-2-(3',5'-dinitro-2'-hydroxyphenylazo)-4-sulfonaphthalene and alkali metal salts thereof SANDOZ LTD. (CH) 1983-11-22 — — US disclosed
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