SCHEMBL8089403

SCHEMBL8089403

COc1cc(OC)c(S(=O)(=O)O)cc1[NH]

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44
KMT2A Q03164 1/20 0.44
TSHR P16473 3/20 0.39
GAA P10253 2/20 0.39
NPBWR1 P48145 1/20 0.39
PKM P14618 2/20 0.38
GSK3B P49841 1/20 0.38
KDM4E B2RXH2 2/20 0.37
NPSR1 Q6W5P4 1/20 0.37
TRPV4 Q9HBA0 1/20 0.37
MPL P40238 1/20 0.35
CDC25A P30304 1/20 0.35
CDC25B P30305 1/20 0.35
HIF1A Q16665 1/20 0.35
CASR P41180 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
POLB P06746 1/20 0.33
MAPK1 P28482 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
SCHEMBL9638669 0.92 ALDH1A1 (0.44) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL7212263 0.89 ALDH1A1 (0.44) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL9774295 0.86 ALDH1A1 (0.50) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL1888725 0.83 ALDH1A1 (0.51) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL343857 0.81 KMT2A (0.41) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL343408 0.79 ALDH1A1 (0.43) ALDH1A1LMNAMAPTKMT2AKDM4E
SCHEMBL13855819 0.78 KMT2A (0.47) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL4649818 0.77 PKM (0.59) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL13517582 0.76 ALDH1A1 (0.43) ALDH1A1LMNAMAPTKMT2ATSHR
SCHEMBL154426 0.76 ALDH1A1 (0.43) ALDH1A1LMNAMAPTKMT2ATSHR

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
US-6146430-A Asymmetric dioxazine compound and method for dyeing or printing fiber Material using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-11-14 US disclosed
US-5977358-A Asymmetric dioxazine compounds, intermediate compounds therefor and application of the asymmetric dioxazine compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-11-02 US disclosed
US-5837869-A CHLORINE-FAST DYE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-11-17 US disclosed