SCHEMBL9459478

SCHEMBL9459478

CC(=O)Nc1cc(N)ccc1S(=O)(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.50
RAPGEF4 Q8WZA2 1/20 0.47
ALDH1A1 P00352 5/20 0.47
CASP6 P55212 3/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPT P10636 3/20 0.47
TDP1 Q9NUW8 3/20 0.47
KMT2A Q03164 3/20 0.47
POLB P06746 2/20 0.47
GAA P10253 2/20 0.47
RECQL P46063 2/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
MEN1 O00255 2/20 0.47
ELAVL1 Q15717 1/20 0.47
CA2 P00918 5/20 0.45
CA1 P00915 4/20 0.45
CA9 Q16790 4/20 0.45
NSD2 O96028 1/20 0.45
APEX1 P27695 1/20 0.45
APOBEC3A P31941 1/20 0.45

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
SCHEMBL3830815 0.87 RAPGEF4 (0.59) NPC1RAPGEF4ALDH1A1CASP6KDM4E
SCHEMBL31219804 0.87 L3MBTL1 (0.51) NPC1ALDH1A1KDM4EMAPTTDP1
SCHEMBL11358245 0.87 CA1 (0.53) NPC1ALDH1A1KDM4EMAPTTDP1
SCHEMBL17491048 0.82 HDAC2 (0.47) NPC1RAPGEF4ALDH1A1CASP6KDM4E
SCHEMBL9459840 0.82 ALDH1A1 (0.48) RAPGEF4ALDH1A1CASP6KDM4EMAPT
SCHEMBL14678160 0.82 NT5E (0.58) NPC1ALDH1A1CASP6KMT2AMEN1
SCHEMBL8592935 0.81 CASP6 (0.61) NPC1ALDH1A1CASP6KDM4EMAPT
SCHEMBL16272370 0.81 ENPP2 (0.57) NPC1ALDH1A1CASP6KDM4EMAPT
SCHEMBL7564333 0.81 RAPGEF4 (0.51) RAPGEF4ALDH1A1CASP6KDM4EMAPT
SCHEMBL9811326 0.80 CA2 (0.47) NPC1ALDH1A1KDM4EMAPTTDP1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0333656-A1 Reactive dyes, process for their preparation and their use CIBA-GEIGY AG (CH) 1989-09-20 EP claimed
CN-103554977-A Golden yellow reactive dye TIANJIN DEKAI CHEM IND CO LTD 2014-02-05 CN disclosed
US-5206426-A Phenylene diamines and process for the preparation of phenylene diamines BASF AKTIENGESELLSCHAFT (DE) 1993-04-27 US disclosed
EP-0396077-B1 PHENYLENE DIAMINES AND A PROCESS FOR THEIR PREPARATION BASF Aktiengesellschaft (DE) 1993-04-07 EP disclosed
US-5118826-A Colorfastness CIBA-GEIGY CORPORATION (US) 1992-06-02 US disclosed
US-5117050-A PHENYLENE DIAMINES AND PROCESS FOR THE PREPARATION OF PHENYLENE DIAMINES BASF AKTIENGESELLSCHAFT (DE) 1992-05-26 US disclosed
US-5021557-A Copper-containing formazan dye, colorfast blue shades on cellulose CIBA-GEIGY CORPORATION (US) 1991-06-04 US disclosed
EP-0396077-A1 Phenylene diamines and a process for their preparation BASF Aktiengesellschaft (DE) 1990-11-07 EP disclosed
EP-0333656-A1 Reactive dyes, process for their preparation and their use CIBA-GEIGY AG (CH) 1989-09-20 EP disclosed
EP-0315585-A1 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1989-05-10 EP disclosed
EP-0122881-B1 REACTIVE DYES, THEIR PREPARATION AND THEIR USE CIBA-GEIGY AG (CH) 1986-08-13 EP disclosed
US-4545785-A FIBER-REACTIVE DYES FOR CELLULOSE CIBA-GEIGY CORPORATION (US) 1985-10-08 US disclosed
US-4504273-A MONOAZO, TRIAZINE CIBA-GEIGY CORPORATION (US) 1985-03-12 US disclosed
EP-0122881-A1 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1984-10-24 EP disclosed
EP-0105027-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1984-04-04 EP disclosed
EP-0012716-B1 MONOCHLOROTRIAZINE DYESTUFFS OF THE PYRAZOLONE SERIES, THEIR PREPARATION AND THEIR USE FOR DYEING AND PRINTING TEXTILE MATERIALS CIBA-GEIGY AG (CH) 1983-06-15 EP disclosed
US-4348318-A DYEING AND PRINTING TEXTILES; MONOAZO, TRIAZINE, HYDRAZONE, AND PYRAZOLONE DYES CIBA-GEIGY CORPORATION (US) 1982-09-07 US disclosed
EP-0012716-A1 Monochlorotriazine dyestuffs of the pyrazolone series, their preparation and their use for dyeing and printing textile materials CIBA-GEIGY AG (CH) 1980-06-25 EP disclosed
US-4138558-A Anthraquinone compounds NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1979-02-06 US disclosed
US-4035350-A Process for the preparation of water-soluble azo dyestuffs by reacting an aromatic amine and a coupling component with alkali metal nitrite or alkyl nitrite in the absence of acid HOECHST AKTIENGESELLSCHAFT (DT) 1977-07-12 US disclosed