SCHEMBL8770833

SCHEMBL8770833

O=S(=O)(O)Oc1cc2ccccc2cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.43
CA2 P00918 4/20 0.43
CA9 Q16790 4/20 0.43
FABP1 P07148 1/20 0.43
SLC22A6 Q4U2R8 1/20 0.42
SLC2A1 P11166 1/20 0.38
CISD1 Q9NZ45 1/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 2/20 0.37
HPGD P15428 2/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MEN1 O00255 1/20 0.37
MITF O75030 1/20 0.37
MAPT P10636 1/20 0.37
KMT2A Q03164 1/20 0.37
NCOA1 Q15788 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NCOA3 Q9Y6Q9 1/20 0.37
GLA P06280 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
SCHEMBL11496987 0.84 GAA (0.47) CA1CA2CA9SLC22A6CISD1
SCHEMBL8017039 0.84 GAA (0.47) CA1CA2CA9SLC22A6CISD1
SCHEMBL31442188 0.79 CA1 (0.40) CA1CA2CA9HPGDKDM4E
Naphthalene SCHEMBL27698306 0.76 FABP1 (0.49) CA1CA2CA9FABP1SLC22A6
SCHEMBL29382842 0.75 HSD11B1 (0.50) CA1CA2CA9FABP1SLC22A6
SCHEMBL235067 0.75 HSD11B1 (0.50) CA1CA2CA9FABP1SLC22A6
SCHEMBL27494241 0.74 FABP1 (0.48) CA1CA2CA9FABP1SLC22A6
SCHEMBL514247 0.74 SLC22A6 (0.53) CA1CA2CA9FABP1SLC22A6
SCHEMBL9541027 0.74 HSD11B1 (0.49) CA1CA2CA9FABP1SLC22A6
Ammonia Solution, Strong SCHEMBL11405643 0.74 HSD11B1 (0.49) CA1CA2CA9FABP1SLC22A6

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
EP-0629395-B1 Keratinous fiber treatment compositions KAO CORP (JP) 1997-10-01 EP disclosed
EP-0629395-A1 Keratinous fiber treatment compositions Kao Corporation (JP) 1994-12-21 EP disclosed
US-3950171-A THERMOPLASTIC RESIN DIAZONIUM SALT MITA INDUSTRIAL CO. LTD. (JA) 1976-04-13 US disclosed