SCHEMBL3374952

SCHEMBL3374952

C=C(Br)C(=O)Nc1c[c]c(S(=O)(=O)O)cc1

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.30

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
SCHEMBL3379991 0.78 TDP1 (0.35)
SCHEMBL6592103 0.78 CA1 (0.46)
SCHEMBL3377417 0.75 ALDH1A1 (0.37)
SCHEMBL7514937 0.69 NT5E (0.38)
SCHEMBL7723677 0.69 CTDSP1 (0.45)
SCHEMBL31598547 0.68 MEN1 (0.55)
SCHEMBL31598552 0.68 ALDH1A1 (0.57) RXFP1
SCHEMBL9166768 0.67 TOP1 (0.47)
SCHEMBL10351093 0.67 TIMP3 (0.30)
SCHEMBL10718747 0.66 NPC1 (0.58)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2035507-B1 DYE MIXTURES OF FIBRE-REACTIVE AZO DYES, PRODUCTION AND USE THEREOF DYSTAR COLOURS DEUTSCHLAND GMB (DE) 2010-11-17 EP disclosed
EP-2035507-A2 DYE MIXTURES OF FIBRE-REACTIVE AZO DYES, PRODUCTION AND USE THEREOF DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 2009-03-18 EP disclosed
WO-2007147774-A2 DYE MIXTURES OF FIBRE-REACTIVE AZO DYES, PRODUCTION AND USE THEREOF DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-12-27 WO disclosed