SCHEMBL7778738

SCHEMBL7778738

O=C(O)c1cccc(Cl)c1C(=O)O.[NaH]

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.63
ALDH1A1 P00352 6/20 0.61
PBRM1 Q86U86 1/20 0.61
DPP4 P27487 1/20 0.48
ALOX15 P16050 1/20 0.48
CES2 O00748 1/20 0.46
CES1 P23141 1/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
LMNA P02545 2/20 0.46
AKR1C3 P42330 2/20 0.46
USP2 O75604 1/20 0.46
MT-CO2 P00403 1/20 0.46
TTR P02766 1/20 0.46
PLA2G1B P04054 1/20 0.46
CYP1A2 P05177 1/20 0.46
PGR P06401 1/20 0.46
CYP3A4 P08684 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46

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
SCHEMBL28702990 1.00 TSHR (0.63) TSHRALDH1A1PBRM1DPP4ALOX15
SCHEMBL275485 0.98 TSHR (0.65) TSHRALDH1A1PBRM1DPP4ALOX15
SCHEMBL31356504 0.98 TSHR (0.65) TSHRALDH1A1PBRM1DPP4ALOX15
SCHEMBL11367294 0.96 TSHR (0.63) TSHRALDH1A1PBRM1DPP4ALOX15
SCHEMBL27672860 0.96 TSHR (0.63) TSHRALDH1A1PBRM1DPP4ALOX15
Phthalic Acid SCHEMBL27858887 0.94 ALDH1A1 (0.65) TSHRALDH1A1PBRM1DPP4ALOX15
Ethylene SCHEMBL29012536 0.94 TSHR (0.61) TSHRALDH1A1PBRM1DPP4ALOX15
SCHEMBL20996701 0.90 TSHR (0.62) TSHRALDH1A1PBRM1DPP4ALOX15
SCHEMBL9725353 0.87 TSHR (0.57) TSHRALDH1A1PBRM1DPP4ALOX15
SCHEMBL1041643 0.86 ALDH1A1 (0.61) TSHRALDH1A1PBRM1DPP4MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111620769-B Method for preparing 3,3 ', 4, 4' -biphenyl tetracarboxylic dianhydride 南通汇顺化工有限公司 2022-06-28 CN claimed
CN-114349642-A Production method of 3-nitrophthalic acid 河北海力香料股份有限公司 2022-04-15 CN claimed
CN-111620769-A Method for preparing 3,3 ', 4, 4' -biphenyl tetracarboxylic dianhydride 南通汇顺化工有限公司 2020-09-04 CN claimed
JP-1254773-A None JP disclosed
CN-117398933-A Circulation reaction device and method for preparing 3,3', 4' -biphenyl sodium tetra-formate by using same 上海旭流化学科技有限公司 2024-01-16 CN disclosed
CN-114621078-B Preparation method of 4-chlorophthalic acid monosodium salt and 4-chlorophthalic anhydride 河北海力恒远新材料股份有限公司 2023-10-31 CN disclosed
CN-114621078-B Preparation method of 4-chlorophthalic acid monosodium salt and 4-chlorophthalic anhydride 河北海力恒远新材料股份有限公司 2023-10-31 CN disclosed
CN-116332747-A Method for preparing biphenyl tetracarboxylic acid based on palladium-carbon catalyst and activation method of palladium-carbon catalyst 河北东丽新材料有限公司 2023-06-27 CN disclosed
CN-114478234-B Refining method of 4-chlorophthalic acid monosodium salt crude product 河北海力恒远新材料股份有限公司 2023-03-31 CN disclosed
CN-115521279-A Preparation method of 4-halogenated phthalic anhydride and 4-halogenated phthalic anhydride obtained by using method 中国石油化工股份有限公司 2022-12-27 CN disclosed
CN-114853705-A Method for preparing chlorophthalic anhydride by recovering 4-chlorophthalic acid monosodium salt reaction mother liquor 河北海力香料股份有限公司 2022-08-05 CN disclosed
EP-0409172-B1 Process for dimerizing aromatic halogen compounds MITSUBISHI CHEM IND (JP) 1994-05-04 EP disclosed
US-5177258-A Coupling an Aryl Halide, Palladium Catalyst, Formic Hydrazide Reducing Agent BROMINE COMPOUNDS, LTD. (IL) 1993-01-05 US disclosed
EP-0514821-A1 Improved method of production of biaryl derivatives Bromine Compounds Ltd. (IL) 1992-11-25 EP disclosed
EP-0318634-B1 PROCESS FOR DIMERIZATION OF AROMATIC HALIDE COMPOUNDS MITSUBISHI KASEI CORPORATION (JP) 1992-03-25 EP disclosed
US-5095144-A Catalytic, dehalogenation MITSUBISHI KASEI CORPORATION (JP) 1992-03-10 US disclosed
EP-0409172-A2 Process for dimerizing aromatic halogen compounds MITSUBISHI KASEI CORPORATION (JP) 1991-01-23 EP disclosed
US-4900843-A Method for dimerization of aromatic halide compounds MITSUBISHI CHEMICAL INDUSTRIES LIMITED (JP) 1990-02-13 US disclosed
JP-H01254773-A PRODUCTION OF LOW CHLORINATED COPPER PHTHALOCYANINE BLUE PIGMENT DAINICHISEIKA COLOR & CHEM MFG CO LTD 1989-10-11 JP disclosed
EP-0318634-A1 Process for dimerization of aromatic halide compounds MITSUBISHI KASEI CORPORATION (JP) 1989-06-07 EP disclosed