SCHEMBL10708486

SCHEMBL10708486

O=S(=O)(CCO)Nc1ccccc1O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.49
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
HTT P42858 2/20 0.49
MAPT P10636 1/20 0.49
MAPK1 P28482 1/20 0.49
RECQL P46063 1/20 0.49
PTGES2 Q9H7Z7 6/20 0.45
UQCRB P14927 1/20 0.45
HSD17B2 P37059 1/20 0.45
PSIP1 O75475 1/20 0.42
DDX3X O00571 1/20 0.41
GFER P55789 1/20 0.41
ACHE P22303 1/20 0.40
CA2 P00918 1/20 0.40
ALDH1A1 P00352 1/20 0.39
POLB P06746 1/20 0.39
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NPC1 O15118 1/20 0.39

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
SCHEMBL28215783 0.83 PARP14 (0.52) GAAMEN1KMT2AHTTMAPT
SCHEMBL9488680 0.81 EP300 (0.61) GAAMEN1KMT2AHTTMAPT
SCHEMBL4965384 0.81 GAA (0.49) GAAMEN1KMT2AHTTMAPT
SCHEMBL11871635 0.80 PGAM1 (0.57) GAAMEN1KMT2AHTTMAPT
SCHEMBL11442426 0.79 PGAM1 (0.52)
SCHEMBL10808948 0.79 KEAP1 (0.57) GAAMEN1KMT2AHTTMAPT
SCHEMBL9502605 0.79 ALDH1A1 (0.51) MEN1KMT2AALDH1A1POLB
SCHEMBL6566936 0.78 CA1 (0.56) GAAMEN1KMT2AHTTMAPT
SCHEMBL10886862 0.78 PGAM1 (0.51)
SCHEMBL9821282 0.78 PTGES2 (0.52) MEN1KMT2AHTTPTGES2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0144701-B1 PROCESS FOR THE PREPARATION OF 2-AMINO-1-HYDROXY-4-OR-5-(BETA-SULFATOETHYLSULFONYL)-BENZENE COMPOUNDS AND THEIR USE FOR THE SYNTHESIS OF FIBER-REACTIVE COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1988-03-16 EP disclosed
EP-0144701-A2 Process for the preparation of 2-amino-1-hydroxy-4-or-5-(beta-sulfatoethylsulfonyl)-benzene compounds and their use for the synthesis of fiber-reactive compounds HOECHST AKTIENGESELLSCHAFT (DE) 1985-06-19 EP disclosed
EP-0035956-B1 PROCESS FOR THE PREPARATION OF SULFATOETHYLSULFONYL COMPOUNDS HOECHST AKTIENGESELLSCHAFT (DE) 1983-02-16 EP disclosed
EP-0035956-A1 Process for the preparation of sulfatoethylsulfonyl compounds HOECHST AKTIENGESELLSCHAFT (DE) 1981-09-16 EP disclosed