SCHEMBL7514937

SCHEMBL7514937

C=C(Br)C(=O)Nc1ccc(S(=O)(=O)O)c(N)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 1/20 0.38
RAPGEF4 Q8WZA2 1/20 0.37
ENPP2 Q13822 2/20 0.36
GRIK1 P39086 1/20 0.34
GRIK2 Q13002 1/20 0.34
TDP1 Q9NUW8 4/20 0.34
ALDH1A1 P00352 3/20 0.34
GAA P10253 3/20 0.34
CASP6 P55212 3/20 0.34
KDM4E B2RXH2 2/20 0.34
POLB P06746 2/20 0.34
MAPT P10636 2/20 0.34
RECQL P46063 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
CTDSP1 Q9GZU7 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ELAVL1 Q15717 1/20 0.34
NPC1 O15118 1/20 0.33
RAB9A P51151 1/20 0.33

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
SCHEMBL7723677 0.88 CTDSP1 (0.45) NT5ERAPGEF4ENPP2GRIK1GRIK2
SCHEMBL7510427 0.85 RAPGEF4 (0.37) NT5ERAPGEF4ENPP2GRIK1GRIK2
SCHEMBL7517671 0.85 TDP1 (0.48) NT5ERAPGEF4ENPP2TDP1ALDH1A1
SCHEMBL10803184 0.84 GPR35 (0.37) NT5ERAPGEF4ENPP2TDP1ALDH1A1
SCHEMBL11340190 0.83 GPR35 (0.49) NT5ERAPGEF4ENPP2TDP1ALDH1A1
SCHEMBL6937725 0.80 NT5E (0.52) NT5ERAPGEF4ENPP2TDP1ALDH1A1
SCHEMBL10480106 0.79 RAPGEF4 (0.36) NT5ERAPGEF4GRIK1GRIK2TDP1
SCHEMBL7512999 0.79 RAPGEF4 (0.36) NT5ERAPGEF4GRIK1GRIK2TDP1
SCHEMBL1755227 0.78 ENPP2 (0.56) ENPP2TDP1ALDH1A1MAPTL3MBTL1
SCHEMBL7511077 0.78 GSTO1 (0.49) ENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6407220-B1 FOR DYEING AND PRINTING OF MATERIALS CONTAINING CELLULOSE FIBERS; HIGH FIXATION AND GOOD BUILD-UP EVERLIGHT USA, INC. 2002-06-18 US disclosed
EP-0699719-B1 Azodyes, process for their preparation and the use thereof CIBA SC HOLDING AG (CH) 2002-01-02 EP disclosed
US-5616695-A YELLOW DYES HAVING GOOD FASTNESS PROPERTIES CIBA-GEIGY CORPORATION (US) 1997-04-01 US disclosed
EP-0699719-A2 Azodyes, process for their preparation and the use thereof CIBA-GEIGY AG (CH) 1996-03-06 EP disclosed
US-4801694-A Triazinyl reactive dyestuffs in which triazinyl group is further substituted with a beta-chloroethylsulfonyl- or vinylsulfonylbutyrylamino moiety CIBA-GEIGY CORPORATION (US) 1989-01-31 US disclosed
US-4068085-A YELLOW AND RED ON POLYESTERS AND ACRYLICS CIBA-GEIGY CORPORATION (US) 1978-01-10 US disclosed
US-4033943-A Fiber reactive water soluble 2,4,6-triamino, 3-cyano pyridine-(5) azo dyestuffs CIBA-GEIGY CORPORATION (US) 1977-07-05 US disclosed