SCHEMBL9750152

SCHEMBL9750152

CCOc1cc(N=Nc2cc(Cl)c(S(=O)(=O)CCOS(=O)(=O)O)cc2Cl)c(OCC)c(S(=O)(=O)O)c1N

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.31
HTT P42858 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MAPT P10636 1/20 0.30
TSHR P16473 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
SCHEMBL9809482 0.75 HSD17B10 (0.37) LMNAHTTHSD17B10MAPTTSHR
SCHEMBL9750433 0.75 TP53 (0.34) HSD17B10MAPTTSHR
SCHEMBL9750126 0.74 BRD4 (0.41) HTTHSD17B10MAPTTSHR
SCHEMBL9750092 0.72 SENP2 (0.40) MAPT
SCHEMBL7717686 0.69 THRB (0.41) HSD17B10MAPT
SCHEMBL11313797 0.68 HSD17B10 (0.37) LMNAHTTHSD17B10MAPTTSHR
SCHEMBL8951874 0.68 CA2 (0.39) HSD17B10TSHR
SCHEMBL7717673 0.67 KDM4E (0.50) HSD17B10MAPT
SCHEMBL8008875 0.66 HSD17B10 (0.39) HTTHSD17B10MAPTTSHR
SCHEMBL9776619 0.66 HSD17B10 (0.39) HTTHSD17B10MAPTTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5093484-A Water soluble; colorfast shades on cotton BAYER AKTIENGESELLSCHAFT (DE) 1992-03-03 US disclosed