SCHEMBL8402397

SCHEMBL8402397

CC(=O)Nc1cccc(Nc2cc(S(=O)(=O)O)c(N)c3c2C(=O)c2ccccc2C3=O)c1

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 2/20 0.84
▸ GNG2 P59768 5/20 0.74
▸ GNB1 P62873 5/20 0.74
▸ P2RY4 P51582 10/20 0.71
▸ CYP1A2 P05177 2/20 0.70
▸ CYP2C9 P11712 2/20 0.70
▸ ALOX15 P16050 2/20 0.70
▸ HSD17B10 Q99714 2/20 0.70
▸ ALDH1A1 P00352 1/20 0.70
▸ CYP3A4 P08684 1/20 0.70
▸ HPGD P15428 1/20 0.70
▸ MAPK1 P28482 1/20 0.70
▸ CYP2C19 P33261 1/20 0.70
▸ HIF1A Q16665 1/20 0.70
▸ P2RY2 P41231 8/20 0.69
▸ P2RY12 Q9H244 6/20 0.58
▸ P2RY6 Q15077 3/20 0.58
▸ CDK2 P24941 2/20 0.57
▸ P2RY1 P47900 2/20 0.57
▸ ENPP3 O14638 1/20 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
SCHEMBL11311121 0.99 PHLPP2 (0.82) PHLPP2GNG2GNB1P2RY4CYP1A2
SCHEMBL9173299 0.91 PHLPP2 (1.00) PHLPP2GNG2GNB1P2RY4CYP1A2
SCHEMBL29666889 0.91 PHLPP2 (1.00) PHLPP2GNG2GNB1P2RY4CYP1A2
SCHEMBL2854079 0.90 PHLPP2 (0.98) PHLPP2GNG2GNB1P2RY4CYP1A2
SCHEMBL373603 0.90 GNG2 (0.69) PHLPP2GNG2GNB1P2RY4CYP1A2
SCHEMBL11311118 0.89 P2RY2 (0.84) PHLPP2P2RY4P2RY2P2RY12P2RY6
SCHEMBL29637848 0.89 P2RY2 (0.84) PHLPP2P2RY4P2RY2P2RY12P2RY6
SCHEMBL14379194 0.89 GNG2 (0.70) PHLPP2GNG2GNB1P2RY4CYP1A2
SCHEMBL11502964 0.87 GNG2 (0.71) PHLPP2GNG2GNB1P2RY4CYP1A2
SCHEMBL27995224 0.87 GNG2 (0.67) PHLPP2GNG2GNB1P2RY4CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-58125758-A — — None — — JP disclosed
EP-2546309-B1 ANTHRAPYRIDONE SULPHONIC ACID COMPOUNDS, PREPARATION AND USE THEREOF UNIV DALIAN TECH (CN) 2016-06-01 — — EP disclosed
US-8968453-B2 Anthrapyridone sulfonic acid compounds and their preparation methods and applications Zhuhai Ninestar Management Co., Ltd. (CN) 2015-03-03 — — US disclosed
US-8968453-B2 Anthrapyridone sulfonic acid compounds and their preparation methods and applications Zhuhai Ninestar Management Co., Ltd. (CN) 2015-03-03 — — US disclosed
US-8961621-B2 Azo dyes HUNTSMAN INTERNATIONAL LLC (US) 2015-02-24 — — US disclosed
US-20140304926-A1 Azo Dyes HUNTSMAN INTERNATIONAL LLC 2014-10-16 — — US disclosed
WO-2013087400-A2 AZO DYES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2013-06-20 — — WO disclosed
EP-2546309-A1 ANTHRAPYRIDONE SULPHONIC ACID COMPOUNDS, PREPARATION AND USE THEREOF Dalian University Of Technology (CN) 2013-01-16 — — EP disclosed
US-20090100611-A1 Acid Dye Composition of Anthraquinone Dyes CLARIANT FINANCE (BVI) LIMITED (VG) 2009-04-23 — — US disclosed
WO-2007028665-A1 ACID DYE COMPOSITION OF ANTHRAQUINONE DYES CLARIANT INTERNATIONAL LTD (CH) 2007-03-15 — — WO disclosed
EP-0924266-A1 Mixtures of dyes and their use Ciba SC Holding AG (CH) 1999-06-23 — — EP disclosed
JP-S58125758-A ANIONIC DYE COMPOSITION SUMITOMO CHEM CO LTD 1983-07-26 — — JP disclosed
US-4260389-A FINISHING AGENT, WATER, FOAMING AGENT; DYEING SANDOZ LTD. (CH) 1981-04-07 — — US disclosed
US-4146363-A Dyeing synthetic polyamides BAYER AKTIENGESELLSCHAFT (DE) 1979-03-27 — — US disclosed
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