SCHEMBL8043506

SCHEMBL8043506

CCOC(=O)CCc1cccc(I)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 4/20 0.55
CYP4A11 Q02928 4/20 0.55
TDP1 Q9NUW8 1/20 0.49
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
CYP4Z1 Q86W10 1/20 0.45
SYK P43405 2/20 0.44
ALOX5 P09917 1/20 0.44
ALDH1A1 P00352 1/20 0.44
GAA P10253 1/20 0.44
APP P05067 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE3A Q14432 1/20 0.43
P2RY12 Q9H244 1/20 0.43
ABCB1 P08183 1/20 0.43
PTPN1 P18031 1/20 0.43

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
Phenyl Propionic Acid SCHEMBL8043510 0.92 TDP1 (0.53) CYP4F2CYP4A11TDP1CYP4Z1ALOX5
SCHEMBL4425984 0.89 CYP4F2 (0.64) CYP4F2CYP4A11TDP1PPARGPPARA
SCHEMBL8662320 0.88 PPARA (0.54) CYP4F2CYP4A11PPARGPPARACYP4Z1
SCHEMBL1273755 0.84 L3MBTL1 (0.45) PPARGPPARACYP4Z1ALDH1A1
SCHEMBL30628320 0.84 L3MBTL1 (0.45) PPARGPPARACYP4Z1ALDH1A1
SCHEMBL879289 0.84 CYP4F2 (0.58) CYP4F2CYP4A11TDP1PPARGPPARA
SCHEMBL13104077 0.84 CYP4F2 (0.58) CYP4F2CYP4A11TDP1PPARGPPARA
SCHEMBL972580 0.84 SIRT2 (0.51) CYP4F2CYP4A11TDP1ALDH1A1PTPN1
SCHEMBL2745464 0.83 CYP4F2 (0.57) CYP4F2CYP4A11TDP1PPARGPPARA
SCHEMBL10725552 0.83 CYP4F2 (0.61) CYP4F2CYP4A11TDP1PPARGPPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107778259-A A kind of preparation method of azole compounds 湖南华腾制药有限公司 2018-03-09 CN disclosed
CN-107778258-A A kind of preparation method of the triazole compounds containing iodine 湖南华腾制药有限公司 2018-03-09 CN disclosed
CN-107400096-A A kind of synthetic method of triazole compounds 湖南华腾制药有限公司 2017-11-28 CN disclosed
EP-0713149-B1 Electrophotographic photoreceptor using charge transporting copolyester FUJI XEROX CO LTD (JP) 2000-08-23 EP disclosed
EP-0686879-B1 Charge-transporting polymer and organic electronic device using the same FUJI XEROX CO LTD (JP) 2000-05-24 EP disclosed
US-5770339-A DICARBOXYLIC ACID COMPONENT CONTAINS ONE OR TWO TERTIARY AMINE GROUPS, IMPROVED SOLUBILITY, FILM FORMATION, CONTROLLABLE IONIZATION POTENTIAL FUJI XEROX CO., LTD. (JP) 1998-06-23 US disclosed
US-5731118-A Charge transporting random copolyester resin, process for producing the same and organic electronic device using the same FUJI XEROX CO., LTD. (JP) 1998-03-24 US disclosed
US-5604064-A USEFUL IN ELECTROPHOTOGRAPHIC PHOTORECEPTORS FUJI XEROX CO., LTD. (JP) 1997-02-18 US disclosed
EP-0713149-A1 Organic electronic device using charge transporting copolyester FUJI XEROX CO., LTD. (JP) 1996-05-22 EP disclosed
EP-0687958-A1 Charge-transporting polymer and organic electron device using same FUJI XEROX CO., LTD. (JP) 1995-12-20 EP disclosed
EP-0686879-A1 Charge-transporting polymer and organic electronic device using the same FUJI XEROX CO., LTD. (JP) 1995-12-13 EP disclosed