SCHEMBL10691584

SCHEMBL10691584

CC(N)Cc1ccc(NN)cc1S(=O)(=O)CCS(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
TAAR1 Q96RJ0 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
SCHEMBL10692809 0.80 HTR6 (0.32) LMNA
SCHEMBL10694766 0.78 APP (0.35) LMNA
SCHEMBL10335817 0.68 RAD51 (0.33)
SCHEMBL9079841 0.67 EGFR (0.41) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL11701352 0.66 RAPGEF4 (0.43) KDM4EALDH1A1GAAMAPT
SCHEMBL11233324 0.66 CA12 (0.40) KDM4ELMNAGAAMAPT
SCHEMBL10692298 0.64 FBP1 (0.32) ALDH1A1MAPT
SCHEMBL10691575 0.64 RAPGEF4 (0.39) KDM4EALDH1A1GAAMAPT
SCHEMBL19465710 0.62 CTDSP1 (0.40) KDM4EALDH1A1LMNAGAAMAPT
SCHEMBL9717209 0.61 RAPGEF4 (0.42) KDM4EALDH1A1GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4785099-A FIBER-REACTIVE DYES FOR CELLULOSE HOECHST AKTIENGESELLSCHAFT (DE) 1988-11-15 US disclosed
EP-0229339-A2 Water soluble triphene dioxazine compounds, their starting compounds containing sulphonyl groups, process for their preparation and use of the triphene dioxazines as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1987-07-22 EP disclosed