SCHEMBL9815798

SCHEMBL9815798

C=Cc1ccc(S(=O)(=O)OS(=O)(=O)C=C)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.57
ALDH1A1 P00352 3/20 0.42
TSHR P16473 2/20 0.37
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MAPT P10636 1/20 0.37
XBP1 P17861 1/20 0.37
MAPK1 P28482 1/20 0.37
HTT P42858 1/20 0.37
RAB9A P51151 1/20 0.37
MDM2 Q00987 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
HSD17B10 Q99714 1/20 0.37

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
SCHEMBL28022492 0.77 PPARG (0.47) TDP1ALDH1A1TSHRLMNA
SCHEMBL676979 0.77 TDP1 (0.47) TDP1ALDH1A1TSHRNPC1MAPT
SCHEMBL313290 0.76 TDP1 (0.55) TDP1ALDH1A1TSHRNPC1LMNA
SCHEMBL11672865 0.76 TDP1 (0.55) TDP1ALDH1A1TSHRNPC1LMNA
SCHEMBL28724827 0.76 TDP1 (0.55) TDP1ALDH1A1TSHRNPC1LMNA
SCHEMBL28790416 0.76 TDP1 (0.55) TDP1ALDH1A1TSHRNPC1LMNA
SCHEMBL814455 0.76 TDP1 (0.55) TDP1ALDH1A1TSHRNPC1LMNA
SCHEMBL6115133 0.74 TDP1 (0.53) TDP1ALDH1A1TSHRNPC1LMNA
SCHEMBL29045632 0.74 TDP1 (0.53) TDP1ALDH1A1TSHRNPC1LMNA
SCHEMBL452529 0.73 TDP1 (1.00) TDP1ALDH1A1TSHRNPC1LMNA

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
EP-0059428-B2 HAIR TREATMENT COMPOSITIONS KAO SOAP COMPANY, LTD. (JP) 1991-10-02 EP disclosed
EP-0059428-B1 HAIR TREATMENT COMPOSITIONS KAO SOAP COMPANY, LTD. (JP) 1985-05-29 EP disclosed