SCHEMBL9768519

SCHEMBL9768519

CCCCCCCCCCCCCCCc1ccc(CO)c(O)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 1/20 0.58
BCHE P06276 1/20 0.57
TP53 P04637 2/20 0.57
CYP3A4 P08684 2/20 0.57
ALOX15 P16050 2/20 0.57
MEN1 O00255 1/20 0.57
ALOX5 P09917 1/20 0.57
MAPT P10636 1/20 0.57
TYR P14679 1/20 0.57
TSHR P16473 1/20 0.57
HTT P42858 1/20 0.57
KMT2A Q03164 1/20 0.57
TDP1 Q9NUW8 1/20 0.57
ESR1 P03372 2/20 0.55
ADRA2A P08913 2/20 0.55
ADORA3 P0DMS8 2/20 0.55
TACR2 P21452 2/20 0.55
SLC6A2 P23975 2/20 0.55
SLC6A4 P31645 2/20 0.55
SLC6A3 Q01959 2/20 0.55

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
SCHEMBL31414346 0.89 TYR (0.71) PPARABCHETP53CYP3A4ALOX15
SCHEMBL4959142 0.89 TYR (0.71) PPARABCHETP53CYP3A4ALOX15
SCHEMBL4960346 0.89 TYR (0.71) PPARABCHETP53CYP3A4ALOX15
SCHEMBL4957861 0.89 TYR (0.71) PPARABCHETP53CYP3A4ALOX15
SCHEMBL4958674 0.89 TYR (0.71) PPARABCHETP53CYP3A4ALOX15
SCHEMBL4961630 0.89 TYR (0.71) PPARABCHETP53CYP3A4ALOX15
SCHEMBL9651371 0.89 TYR (0.71) PPARABCHETP53CYP3A4ALOX15
SCHEMBL10584994 0.88 BCHE (0.60) PPARABCHETP53CYP3A4ALOX15
SCHEMBL9243041 0.88 PPARA (0.59) PPARABCHETP53CYP3A4ALOX15
SCHEMBL11248095 0.88 TYR (0.69) PPARABCHETP53CYP3A4ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113692403-B Compounds having excited state intramolecular proton transfer (esit) properties for use in the treatment and/or prevention of sunburn and/or prevention of u.v. damage 约翰内斯堡威特沃特斯兰德大学 2024-11-22 CN disclosed
US-5032487-A Reducing agent, storage stability FUJI PHOTO FILM CO., LTD. (JP) 1991-07-16 US disclosed
EP-0386669-A2 Color light-sensitive material FUJI PHOTO FILM CO., LTD. (JP) 1990-09-12 EP disclosed
US-4697038-A COPPER EXTRACTION IN ACID SOLUTION 501 Brunel University (GB) 1987-09-29 US disclosed