SCHEMBL7169769

SCHEMBL7169769

O=C(c1ccc(Sc2ccccc2)cc1)c1ccc(OCCO)cc1O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.55
HPGD P15428 3/20 0.51
LMNA P02545 3/20 0.51
MAPK1 P28482 2/20 0.51
CYP1A2 P05177 2/20 0.51
PGR P06401 2/20 0.51
SLC6A2 P23975 2/20 0.51
CYP2C19 P33261 2/20 0.51
ALDH1A1 P00352 2/20 0.51
CYP2D6 P10635 1/20 0.51
PDE4A P27815 1/20 0.51
HRH1 P35367 1/20 0.51
HTT P42858 1/20 0.51
SLC6A3 Q01959 1/20 0.51
PDE4D Q08499 1/20 0.51
MEN1 O00255 1/20 0.47
USP2 O75604 1/20 0.47
KMT2A Q03164 1/20 0.47
KEAP1 Q14145 1/20 0.47
NFE2L2 Q16236 1/20 0.47

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
SCHEMBL126798 0.88 GAA (0.65) GAAHPGDLMNAMAPK1CYP1A2
SCHEMBL29530425 0.88 GAA (0.65) GAAHPGDLMNAMAPK1CYP1A2
SCHEMBL7169592 0.86 HPGD (0.53) HPGDLMNAMAPK1CYP1A2PGR
SCHEMBL7173457 0.86 HPGD (0.53) HPGDLMNAMAPK1CYP1A2PGR
SCHEMBL10621312 0.86 GAA (0.59) GAAHPGDLMNAMAPK1CYP1A2
SCHEMBL7175178 0.84 HPGD (0.47) GAAHPGDLMNAMAPK1CYP1A2
Fumaric Acid SCHEMBL8443223 0.82 GAA (0.57) GAAHPGDLMNAMAPK1CYP1A2
Maleic Acid SCHEMBL8441601 0.82 GAA (0.57) GAAHPGDLMNAMAPK1CYP1A2
SCHEMBL7172916 0.82 HPGD (0.48) GAAHPGDLMNAMAPK1CYP1A2
SCHEMBL7098970 0.82 HPGD (0.62) GAAHPGDLMNAMAPK1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6586519-B1 Compounds which exhibit enhanced ultraviolet radiation absorption CIBA SPECIALTY CHEMICALS CORPORATION 2003-07-01 US claimed
US-6576797-B1 Thioether substituted hydroxybenzophenones and stabilized compositions CIBA SPECIALTY CHEMICALS CORPORATION 2003-06-10 US claimed
US-6586519-B1 Compounds which exhibit enhanced ultraviolet radiation absorption CIBA SPECIALTY CHEMICALS CORPORATION 2003-07-01 US disclosed
US-6576797-B1 Thioether substituted hydroxybenzophenones and stabilized compositions CIBA SPECIALTY CHEMICALS CORPORATION 2003-06-10 US disclosed
EP-0675108-B1 Thioether substituted hydroxybenzophenones and stabilized compositions CIBA GEIGY AG (CH) 1998-06-10 EP disclosed
EP-0675108-A1 Thioether substituted hydroxybenzophenones and stabilized compositions CIBA-GEIGY AG (CH) 1995-10-04 EP disclosed