Octabenzone

Octabenzone

SCHEMBL7051498

CCCCCCCCOc1ccc(C(=O)c2ccccc2)c(O)c1.O=C(c1ccccc1O)c1ccccc1O

nearest known ligand 0.59

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.59
LMNA P02545 2/20 0.56
CYP1A2 P05177 2/20 0.56
PGR P06401 2/20 0.56
SLC6A2 P23975 2/20 0.56
CYP2C19 P33261 2/20 0.56
ALDH1A1 P00352 1/20 0.56
CYP2D6 P10635 1/20 0.56
PDE4A P27815 1/20 0.56
MAPK1 P28482 1/20 0.56
HRH1 P35367 1/20 0.56
HTT P42858 1/20 0.56
SLC6A3 Q01959 1/20 0.56
PDE4D Q08499 1/20 0.56
PTPN11 Q06124 2/20 0.55
CYP3A4 P08684 1/20 0.54
ADORA3 P0DMS8 1/20 0.54
AR P10275 1/20 0.54
CHRM1 P11229 1/20 0.54
ALOX15 P16050 1/20 0.54

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
Octabenzone SCHEMBL26655814 0.99 HPGD (0.60) HPGDLMNACYP1A2PGRSLC6A2
Dioxybenzone SCHEMBL4204358 0.96 HPGD (0.65) HPGDLMNACYP1A2PGRSLC6A2
Octabenzone SCHEMBL1972225 0.96 HPGD (0.65) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL2063868 0.95 HPGD (0.64) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL11679030 0.95 HPGD (0.64) HPGDLMNACYP1A2PGRSLC6A2
Octabenzone SCHEMBL27387 0.95 HPGD (0.64) HPGDLMNACYP1A2PGRSLC6A2
Octabenzone SCHEMBL8924481 0.95 HPGD (0.64) HPGDLMNACYP1A2PGRSLC6A2
SCHEMBL2805631 0.95 HPGD (0.64) HPGDLMNACYP1A2PGRSLC6A2
Octabenzone SCHEMBL10628531 0.95 HPGD (0.64) HPGDLMNACYP1A2PGRSLC6A2
Octabenzone SCHEMBL10805004 0.95 HPGD (0.64) HPGDLMNACYP1A2PGRSLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1445282-A1 RESIN COMPOSITION AND MOLDED ARTICLE FILM AND FIBER EACH COMPRISING THE SAME TORAY INDUSTRIES, INC. (JP) 2004-08-11 EP disclosed