SCHEMBL10939749

SCHEMBL10939749

O=CCC(c1ccccc1)(c1ccccc1)S(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
ALDH1A1 P00352 2/20 0.38
PTPN1 P18031 2/20 0.38
HTT P42858 1/20 0.36
CYP2D6 P10635 1/20 0.36
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA5A P35218 1/20 0.34
CA9 Q16790 1/20 0.34
CYP2C19 P33261 3/20 0.33
HIF1A Q16665 1/20 0.33
CYP1A2 P05177 2/20 0.32
KMT2A Q03164 1/20 0.32
ACP1 P24666 2/20 0.32
CYP2C9 P11712 1/20 0.31
NR3C2 P08235 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31

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
SCHEMBL10940596 0.81 TSHR (0.38) TSHRALDH1A1PTPN1HTTCYP2D6
SCHEMBL28084413 0.76 PTPN1 (0.40) TSHRPTPN1CYP2D6MAPK1SMN1; SMN2
SCHEMBL7784198 0.74 ALDH1A1 (0.44) TSHRALDH1A1HTTCYP2D6MAPK1
SCHEMBL27880149 0.71 ALDH1A1 (0.38) TSHRALDH1A1PTPN1HTTCA1
SCHEMBL8009556 0.71 ALDH1A1 (0.42) TSHRALDH1A1PTPN1HTTCYP2D6
SCHEMBL6991557 0.71 CYP2C9 (0.44) TSHRALDH1A1HTTCYP2D6SMN1; SMN2
Fluoride SCHEMBL10634721 0.70 PTPN1 (0.41) ALDH1A1PTPN1CYP2D6MAPK1CA2
SCHEMBL440368 0.70 KIF11 (0.41) TSHRALDH1A1HTTCYP2C19HIF1A
SCHEMBL6544164 0.70 ALDH1A1 (0.41) TSHRALDH1A1PTPN1HTTCYP2C19
SCHEMBL31347871 0.69 GAA (0.41) ALDH1A1PTPN1HTTCYP2D6MAPK1

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-4543166-A NICKEL, COBALT, ELECTRODEPOSITION, BRIGHTENERS, PUCTILITY, SULFONATES OMI INTERNATIONAL CORPORATION (US) 1985-09-24 US disclosed
US-4252619-A Brightener for zinc electroplating solutions and process OXY METAL INDUSTRIES CORPORATION (US) 1981-02-24 US disclosed