SCHEMBL104744

SCHEMBL104744

O=C(Cl)c1cccc(F)c1F

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 6/20 0.68
CES1 P23141 6/20 0.68
ALDH1A1 P00352 4/20 0.68
ALOX15 P16050 1/20 0.68
BCHE P06276 1/20 0.68
HPGD P15428 2/20 0.52
ALB P02768 1/20 0.47
KAT6A Q92794 2/20 0.44
GAA P10253 1/20 0.41
ATM Q13315 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NPC1 O15118 1/20 0.38
MAPT P10636 1/20 0.38
RAB9A P51151 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PTPN1 P18031 1/20 0.37
ERCC5 P28715 1/20 0.37
FEN1 P39748 1/20 0.37

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
Hydrochloric Acid SCHEMBL1422986 0.98 CES2 (0.65) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL8702458 0.92 CES2 (0.59) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL19185970 0.88 ALDH1A1 (0.62) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL3440833 0.81 CES2 (0.74) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL3184940 0.81 CES2 (1.00) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL60101 0.81 ALDH1A1 (1.00) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL30733529 0.81 ALDH1A1 (1.00) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL785155 0.80 ALDH1A1 (0.65) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL29454770 0.80 ALDH1A1 (0.54) CES2CES1ALDH1A1ALOX15BCHE
SCHEMBL9836255 0.80 ALDH1A1 (0.65) CES2CES1ALDH1A1ALOX15BCHE

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 1093 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116891443-B Isoindol-1-one derivative and preparation method and application thereof 潍坊医学院 2023-12-01 CN claimed
CN-115703648-A Modified zinc oxide, preparation method thereof and light-emitting diode TCL科技集团股份有限公司 2023-02-17 CN claimed
CN-113243382-A Emamectin benzoate and hexaflumuron water dispersible granule and preparation method and preparation device thereof 江苏东南植保有限公司 2021-08-13 CN claimed
CN-108358767-B Pentabenzyl benzene-containing difluoride monomer, preparation method and application thereof in polyaryletherketone functional film 吉林大学 2021-06-04 CN claimed
CN-110483326-A 2,6- bis- (p-aminophenyl oxygroup)-N- [(4- anilino-) phenyl] benzamide monomer and preparation method thereof ANYANG INST TECH 2019-11-22 CN claimed
CN-109651354-A - 4 (1H) qualone derivative of 3- (2-[4-morpholinodithio base) and its preparation method and application 广西师范大学 2019-04-19 CN claimed
CN-108358767-A The double fluorine monomers of methylbenzene containing pentaphene, preparation method and its application in poly(aryl ether ketone) functional membrane 吉林大学 2018-08-03 CN claimed
CN-105482098-B The azo polyarylether liquid crystal material of a kind of side chain with Oligoanilines and preparation method thereof 安阳工学院 2017-07-14 CN claimed
CN-105037141-A Carboxyl-containing difluoro monomer, preparation method of difluoro monomer and application of difluoro monomer to preparation of carboxyl-containing polyarylether UNIV JILIN 2015-11-11 CN claimed
CN-104860808-A Difluoro monomer containing tetraphenylethylene groups and application of difluoro monomer for preparing polyaryletherketone polymers UNIV JILIN 2015-08-26 CN claimed
CN-102690228-A Pyridine structure containing benzphenanthrene compound as well as preparation method and applications thereof UNIV CHINA AGRICULTURAL 2012-09-26 CN claimed
CN-102604074-A Electroactive fluorescent polymer, preparation method and use for detecting oxidizing or reducing substance UNIV JILIN 2012-07-25 CN claimed
CN-102382054-A Parazole and isoxazole derivative, preparation method for same and application thereof UNIV PLA 2ND MILITARY MEDICAL 2012-03-21 CN claimed
CN-1785993-B Preparation and use of non-natural isocoumarin derivatives UNIV NANKAI 2012-03-14 CN claimed
CN-101985495-A Side chain type electroactive polyarylether polymer and preparation method thereof UNIV JILIN 2011-03-16 CN claimed
CN-1429206-A Sulfonamide derivatives LILLY CO ELI (US) 2003-07-09 CN claimed
CN-1098844-C Substituted biphenyl oxazolines BAYER AG (DE) 2003-01-15 CN claimed
CN-1122801-A Substituted biphenyl oxazolines BAYER AG (DE) 1996-05-22 CN claimed
CN-1009920-B Halogenated benzoic acid derivatives and their preparation KYORIN SEIYAKU KK (JP) 1990-10-10 CN claimed
CN-87100373-A Halogenated benzoic acid derivative and preparation thereof 1987-08-19 CN claimed