SCHEMBL11224616

SCHEMBL11224616

O=S(=O)(O)c1cc(O)c2c(Nc3nc(F)nc(F)n3)cc(S(=O)(=O)O)cc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 1/20 0.49
NT5E P21589 3/20 0.48
CA12 O43570 3/20 0.41
CA1 P00915 3/20 0.41
CA2 P00918 3/20 0.41
CA4 P22748 3/20 0.41
CA6 P23280 3/20 0.41
CA7 P43166 3/20 0.41
CA9 Q16790 3/20 0.41
CA14 Q9ULX7 3/20 0.41
CA13 Q8N1Q1 2/20 0.41
PRMT1 Q99873 2/20 0.40
CYP2C9 P11712 2/20 0.40
ALDH1A1 P00352 1/20 0.40
CYP2C19 P33261 1/20 0.40
HIF1A Q16665 1/20 0.40
HSD17B10 Q99714 1/20 0.40
FUT8 Q9BYC5 1/20 0.39
PTPN1 P18031 2/20 0.38
MEN1 O00255 2/20 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
SCHEMBL19004055 0.91 APEX1 (0.44) APEX1NT5ECA12CA1CA2
SCHEMBL16560637 0.89 APEX1 (0.46) APEX1NT5ECA12CA1CA2
SCHEMBL16560634 0.88 APEX1 (0.53) APEX1NT5ECA12CA1CA2
SCHEMBL16557824 0.87 APEX1 (0.43) APEX1NT5ECA12CA1CA2
SCHEMBL10938751 0.87 APEX1 (0.46) APEX1NT5ECA12CA1CA2
SCHEMBL16560638 0.87 APEX1 (0.49) APEX1NT5ECA12CA1CA2
SCHEMBL5702813 0.83 FUT8 (0.50) APEX1NT5ECA12CA1CA2
SCHEMBL11230352 0.83 APEX1 (0.49) APEX1NT5EPRMT1CYP2C9ALDH1A1
SCHEMBL30528721 0.83 FUT8 (0.50) APEX1NT5ECA12CA1CA2
SCHEMBL7753503 0.83 CA12 (0.45) APEX1CA12CA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9394445-B2 Method for continuously preparing water-soluble azo dye by coupling a nebulizer with a pipeline DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2016-07-19 US disclosed
US-20150073132-A1 METHOD FOR CONTINUOUSLY PREPARING WATER-SOLUBLE AZO DYE BY COUPLING A NEBULIZER WITH A PIPELINE DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2015-03-12 US disclosed
US-4361698-A Process for the manufacture of dihalogenotriazinylamino-naphthol compounds HOECHST AKTIENGESELLSCHAFT (DE) 1982-11-30 US disclosed
EP-0036133-A2 Process for the preparation of dihalotriazinyl-amino-naphthol compounds HOECHST AKTIENGESELLSCHAFT (DE) 1981-09-23 EP disclosed
EP-0014844-A1 Fluortriazine derivatives, process for the preparation of fluortriazin-derivatives and reactive dyes and their application BAYER AG (DE) 1980-09-03 EP disclosed
US-4189570-A Difluoro-s-triazinylamino-hydroxynaphthalene-sulfonic acid CIBA-GEIGY CORPORATION (US) 1980-02-19 US disclosed