SCHEMBL4304729

SCHEMBL4304729

O=C(O)CC(Cl)(Cl)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
TSHR P16473 3/20 0.46
CYP2C19 P33261 2/20 0.46
HIF1A Q16665 2/20 0.46
CYP2D6 P10635 1/20 0.46
TP53 P04637 1/20 0.44
HMGCR P04035 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
ADRA1A P35348 1/20 0.41
ACLY P53396 3/20 0.39
CPT2 P23786 2/20 0.37
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
FFAR1 O14842 1/20 0.35
MIF P14174 1/20 0.34
LDHA P00338 1/20 0.32
SRR Q9GZT4 1/20 0.32
LMNA P02545 1/20 0.32
ALKBH5 Q6P6C2 1/20 0.32

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
SCHEMBL18710807 0.77 ALDH1A1 (0.40) ALDH1A1TSHRCYP2C19HIF1ACYP2D6
SCHEMBL10970094 0.75 ALDH1A1 (0.48) ALDH1A1TSHRCYP2C19HIF1ACYP2D6
SCHEMBL555590 0.73
SCHEMBL2706813 0.73 ALDH1A1 (0.45) ALDH1A1TSHRCYP2C19HIF1ACYP2D6
SCHEMBL6739152 0.73 ALDH1A1 (0.52) ALDH1A1TSHRCYP2C19HIF1ACYP2D6
SCHEMBL259584 0.71
SCHEMBL8386087 0.71
SCHEMBL134598 0.71
Hydrochloric Acid SCHEMBL8555531 0.71
Water SCHEMBL4737329 0.71

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117720674-A Modified chitosan, preparation method thereof, retarding water reducer and application 科之杰新材料集团有限公司 2024-03-19 CN claimed
CN-113759066-B Thin-layer identification method for allium macrostemon test sample 北京康仁堂药业有限公司 2023-04-18 CN claimed
CN-113759066-A Thin-layer identification method for allium macrostemon test sample 北京康仁堂药业有限公司 2021-12-07 CN claimed
CN-110565124-A Chromium plating solution for automobile ornaments and electroplating method thereof 宣城金诺模塑科技有限公司 2019-12-13 CN claimed
CN-103008919-B Low-silver halogen-free lead-free solder paste CHENZHOU GOLD ARROW SOLDER CO LTD 2015-05-27 CN claimed
CN-103008920-A Leadless rosin core no-clean scaling powder CHENZHOU GOLD ARROW SOLDER CO LTD 2013-04-03 CN claimed
CN-103008919-A Low-silver halogen-free lead-free solder paste CHENZHOU GOLD ARROW SOLDER CO LTD 2013-04-03 CN claimed
CN-101378787-B Antiviral method GOJO IND INC 2013-02-06 CN claimed
CN-101023909-B Composition and method for pre-surgical skin disinfection GOJO IND INC 2012-06-20 CN claimed
US-20090200233-A1 METHODS AND DEVICES FOR THE REMOVAL OF ORGANIC CONTAMINANTS FROM WATER WORCESTER POLYTECHNIC INSTITUTE (US) 2009-08-13 US claimed
US-4847405-A AMINATION, PHASE TRANSFER AGENT AMERICAN CYANAMID COMPANY (US) 1989-07-11 US claimed
EP-0309724-A1 Improved method for the preparation of dialkyl dichlorosuccinates AMERICAN CYANAMID COMPANY (US) 1989-04-05 EP claimed
EP-0309711-A1 Improved method for the preparation of anilinofumarate AMERICAN CYANAMID COMPANY (US) 1989-04-05 EP claimed
US-4814486-A FOR HERBICIDES AMERICAN CYANAMID COMPANY (US) 1989-03-21 US claimed
US-4766218-A CYCLIZATION OF DICHLOROSUCCINATE WITH AMINE AMERICAN CYANAMID COMPANY (US) 1988-08-23 US claimed
EP-0262305-A1 Method for the preparation of anilinofumarate and quinoline-2,3-dicarboxylic acid AMERICAN CYANAMID COMPANY (US) 1988-04-06 EP claimed
US-4675432-A REACT DISHLOROSUCCINATE WITH ANILINE IN SOLVENT, BASE AND PHA SE TRANSFER CATALYST AMERICAN CYANAMID COMPANY (US) 1987-06-23 US claimed
US-4368314-A POLYEPOXIDE MOLDING MATERIALS HAVING SMALL SHRINKAGE TOAGOESI CHEMICAL INDUSTRY CO., LTD. (JP) 1983-01-11 US claimed
US-4197374-A FOAMS, FILMS, FIBERS, COATINGS, ELASTOMERS BASF WYANDOTTE CORPORATION (US) 1980-04-08 US claimed
US-4180607-A 2,3,3',4'-BIPHENYLTETRACARBOXYLIC DIANHYDRIDE UBE INDUSTRIES, LTD. (JP) 1979-12-25 US claimed