SCHEMBL8636714

SCHEMBL8636714

CCn1c(O)c(N=Nc2cc(N)ccc2S(=O)(=O)O)c(C)c(CS(=O)(=O)O)c1=O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATIC P31939 1/20 0.35
▸ SUMO2 P61956 1/20 0.35
▸ SUMO1 P63165 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35
▸ SENP2 Q9HC62 1/20 0.35
▸ MAPT P10636 3/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ CA12 O43570 3/20 0.31
▸ CA1 P00915 3/20 0.31
▸ CA2 P00918 3/20 0.31
▸ CA9 Q16790 3/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ MPL P40238 2/20 0.30
▸ ALDH1A1 P00352 2/20 0.30
▸ BRD4 O60885 1/20 0.30
▸ TP53 P04637 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
SCHEMBL14380145 0.90 MPL (0.40) MAPTPOLBMAPK1ATMCA12
SCHEMBL14445563 0.90 MPL (0.40) MAPTPOLBMAPK1ATMCA12
SCHEMBL8008363 0.88 SUMO2 (0.36) ATICSUMO2SUMO1SENP7SENP2
SCHEMBL14493365 0.87 BRD4 (0.35) SUMO2SUMO1SENP7SENP2MAPT
SCHEMBL10615290 0.87 PHLPP2 (0.35) ATICSUMO2SUMO1SENP7SENP2
SCHEMBL12646668 0.87 MAPT (0.33) MAPTPOLBMAPK1ATMMPL
SCHEMBL10618146 0.86 ALDH1A1 (0.37) ATICSUMO2SUMO1SENP7SENP2
SCHEMBL10616418 0.86 MAPT (0.34) ATICSUMO2SUMO1SENP7SENP2
SCHEMBL18218247 0.85 BRD4 (0.36) MAPTPOLBMAPK1ATMMPL
SCHEMBL18218226 0.85 BRD4 (0.38) MAPTPOLBMAPK1ATMMPL

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-0694053-B1 WATER-SOLUBLE FIBER-REACTIVE DYES, PROCESS FOR PRODUCING THE SAME AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO (DE) 1998-07-22 — — EP disclosed
EP-0694053-A1 WATER-SOLUBLE FIBER-REACTIVE DYES, PROCESS FOR PRODUCING THE SAME AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1996-01-31 — — EP disclosed
WO-1994024214-A1 WATER-SOLUBLE FIBER-REACTIVE DYES, PROCESS FOR PRODUCING THE SAME AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1994-10-27 — — WO disclosed
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