SCHEMBL8429016

SCHEMBL8429016

O=C(c1ccccc1)c1cc(O)cc(S(=O)(=O)O)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.50
KMT2A Q03164 4/20 0.50
LMNA P02545 3/20 0.50
MAPT P10636 2/20 0.50
MEN1 O00255 2/20 0.45
USP2 O75604 1/20 0.45
GAA P10253 1/20 0.45
KEAP1 Q14145 1/20 0.45
NFE2L2 Q16236 1/20 0.45
HPGD P15428 2/20 0.43
MAPK1 P28482 2/20 0.43
CYP1A2 P05177 1/20 0.43
PGR P06401 1/20 0.43
CYP2D6 P10635 1/20 0.43
SLC6A2 P23975 1/20 0.43
PDE4A P27815 1/20 0.43
CYP2C19 P33261 1/20 0.43
HRH1 P35367 1/20 0.43
HTT P42858 1/20 0.43
SLC6A3 Q01959 1/20 0.43

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
SCHEMBL7782795 0.80 AKR1C3 (0.47) ALDH1A1KMT2ALMNAMAPTGAA
SCHEMBL7792233 0.80 KMT2A (0.62) ALDH1A1KMT2ALMNAMAPTMEN1
SCHEMBL7788631 0.75 ALDH1A1 (0.49) ALDH1A1KMT2ALMNAMAPTPGR
SCHEMBL300439 0.73 AKR1C3 (0.55) ALDH1A1KMT2ALMNAMAPTGAA
SCHEMBL547385 0.73 LMNA (0.69) ALDH1A1KMT2ALMNAMAPTMEN1
SCHEMBL11033524 0.72 ALDH1A1 (0.52) ALDH1A1KMT2ALMNAMAPTGAA
SCHEMBL6302167 0.72 LMNA (0.68) ALDH1A1KMT2ALMNAMAPTMEN1
Water SCHEMBL27666388 0.72 AKR1C3 (0.53) ALDH1A1KMT2ALMNAMAPTGAA
SCHEMBL28340031 0.72 AKR1C3 (0.53) ALDH1A1KMT2ALMNAMAPTGAA
SCHEMBL29496654 0.72 AKR1C3 (0.53) ALDH1A1KMT2ALMNAMAPTGAA

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-0662314-B1 Method of hair treatment KAO CORP (JP) 1999-11-03 EP disclosed
EP-0662314-A1 Method of hair treatment Kao Corporation (JP) 1995-07-12 EP disclosed