SCHEMBL8631829

SCHEMBL8631829

Cc1cc(CN)c(Nc2cc(S(=O)(=O)O)c(N)c3c2C(=O)c2ccccc2C3=O)c(S(=O)(=O)O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GNG2 P59768 5/20 0.60
▸ GNB1 P62873 5/20 0.60
▸ P2RY1 P47900 4/20 0.59
▸ ALDH1A1 P00352 3/20 0.59
▸ HPGD P15428 3/20 0.59
▸ MAPK1 P28482 3/20 0.59
▸ MEN1 O00255 2/20 0.59
▸ NSD2 O96028 2/20 0.59
▸ POLB P06746 2/20 0.59
▸ MAPT P10636 2/20 0.59
▸ THRB P10828 2/20 0.59
▸ RECQL P46063 2/20 0.59
▸ KMT2A Q03164 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ NPSR1 Q6W5P4 2/20 0.59
▸ TDP1 Q9NUW8 2/20 0.59
▸ L3MBTL1 Q9Y468 2/20 0.59
▸ PHLPP2 Q6ZVD8 2/20 0.57
▸ P2RY4 P51582 11/20 0.55
▸ CYP1A2 P05177 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
SCHEMBL8630917 0.90 ALDH1A1 (0.50) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL8634590 0.90 GNG2 (0.61) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL8022972 0.86 ALDH1A1 (0.45) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL11333865 0.85 ALDH1A1 (0.79) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL8634821 0.85 GNG2 (0.60) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL30205040 0.84 ALDH1A1 (0.77) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL3028166 0.84 ALDH1A1 (0.77) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL13214098 0.82 GNG2 (0.78) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL11679423 0.82 GNG2 (0.61) GNG2GNB1P2RY1ALDH1A1HPGD
SCHEMBL8630004 0.81 GNG2 (0.66) GNG2GNB1P2RY1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1795562-A2 Fiber reactive dyestuffs Everlight USA, Inc. (US) 2007-06-13 — — EP disclosed
EP-0602550-B1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffes DYSTAR TEXTILFARBEN GMBH & CO (DE) 1998-08-19 — — EP disclosed
EP-0601416-B1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffs DYSTAR TEXTILFARBEN GMBH & CO (DE) 1998-07-15 — — EP disclosed
EP-0513622-B1 Reactive dyes BAYER AG (DE) 1996-08-28 — — EP disclosed
US-5498713-A FIBER-REACTIVE DYES HOECHST AKTIENGESELLSCHAFT (DE) 1996-03-12 — — US disclosed
US-5430147-A Water-soluble anthraquinone compounds, preparation thereof, and use thereof as dyes HOECHST AG (DE) 1995-07-04 — — US disclosed
EP-0501266-B1 Bifunctional reactive dyes BAYER AG (DE) 1995-06-21 — — EP disclosed
US-5420256-A 2-amino-4-phenylamino-1,3,5-triazinyl reactive dyestuffs, process for their preparation and their use dye cellulose or polyamides BAYER AKTIENGESELLSCHAFT (DE) 1995-05-30 — — US disclosed
US-5340928-A Dyeing and printing natural and synthetic fibers; contains sulfo containing radical of dyestuff BAYER AKTIENGESELLSCHAFT (DE) 1994-08-23 — — US disclosed
EP-0602550-A1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffes HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-22 — — EP disclosed
EP-0601416-A1 Watersoluble anthraquinone compounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1994-06-15 — — EP disclosed
US-5256774-A Bifunctional reactive dyestuffs containing the 2-(N-substituted amino)-4-(N-phenylamino)-1,3,5-trlazinyl moiety BAYER AKTIENGESELLSCHAFT (DE) 1993-10-26 — — US disclosed
EP-0513622-A1 Reactive dyes BAYER AG (DE) 1992-11-19 — — EP disclosed
EP-0501266-A1 Bifunctional reactive dyes BAYER AG (DE) 1992-09-02 — — EP disclosed
EP-0501252-A1 Bifuntional reactive alges BAYER AG (DE) 1992-09-02 — — EP disclosed
US-4242259-A TRIAZINE DYES, COTTON BAYER AKTIENGESELLSCHAFT (DE) 1980-12-30 — — US disclosed
US-4105662-A FIBER REACTIVE ON COTTON, WOOL BAYER AKTIENGESELLSCHAFT (DE) 1978-08-08 — — US disclosed
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