SCHEMBL8779976

SCHEMBL8779976

NCCNCCS(=O)(=O)CCCl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 5/20 0.43
CA6 P23280 5/20 0.43
CA7 P43166 5/20 0.43
CA9 Q16790 5/20 0.43
CA14 Q9ULX7 5/20 0.43
CA5B Q9Y2D0 5/20 0.43
MEN1 O00255 2/20 0.43
RECQL P46063 2/20 0.43
KMT2A Q03164 2/20 0.43
CA2 P00918 4/20 0.42
CA4 P22748 4/20 0.42
CA5A P35218 4/20 0.42
LMNA P02545 3/20 0.42
CA3 P07451 3/20 0.42
ALOX15 P16050 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
CA1 P00915 2/20 0.42
ALDH1A1 P00352 1/20 0.42
TP53 P04637 1/20 0.42
KDM4E B2RXH2 1/20 0.40

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
Hydrochloric Acid SCHEMBL10392658 0.98 KDM4E (0.44) CA12CA6CA7CA9CA14
SCHEMBL7760484 0.89
Hydrochloric Acid SCHEMBL7828492 0.86
SCHEMBL9337359 0.84
SCHEMBL8480622 0.79
SCHEMBL7840916 0.79 TSHR (0.41) CA12CA7CA14MEN1KMT2A
SCHEMBL8082063 0.78
SCHEMBL7838213 0.78 CA1 (0.36) CA1
SCHEMBL9551399 0.78 ALDH1A1 (0.50) CA12CA7CA14CA2CA1
Hydrochloric Acid SCHEMBL8989710 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0492128-B1 Triazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL CO (JP) 1997-06-04 EP disclosed
EP-0382111-B1 Copper complex-formazane compounds, process for their preparation and their use as dyestuffs HOECHST AG (DE) 1994-06-08 EP disclosed
US-5235046-A Colorfast, washfast SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1993-08-10 US disclosed
EP-0492128-A1 Triazine compounds and method for dyeing or printing fiber materials using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-07-01 EP disclosed
US-5015731-A For fibers such as wool and cellulose HOECHST AKTIENGESELLSCHAFT (DE) 1991-05-14 US disclosed
US-4963659-A DYEING CELLULOSE, PRINTING TEXTILES CIBA-GEIGY CORPORATION (US) 1990-10-16 US disclosed
US-4925928-A Reactive dyes containing vinylsulfonylalkylamino bound to a bis-(triazinylamino)-benzene group CIBA-GEIGY CORPORATION (US) 1990-05-15 US disclosed
US-4925927-A COTTON CIBA-GEIGY CORPORATION (US) 1990-05-15 US disclosed
US-4918169-A COTTON CIBA-GEIGY CORPORATION (US) 1990-04-17 US disclosed
US-4786721-A DYEING OR PRINTING CELLULOSE FIBERS CIBA-GEIGY CORPORATION (US) 1988-11-22 US disclosed
US-4766206-A Reactive dyestuffs comprising a vinylsulfonylalkylaminocarbonyl moiety CIBA-GEIGY CORPORATION (US) 1988-08-23 US disclosed