SCHEMBL1845000

SCHEMBL1845000

Clc1ccc(C(Cl)(Cl)Cl)c(Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 1.00
CYP3A4 P08684 4/20 1.00
TDP1 Q9NUW8 3/20 1.00
MAPK1 P28482 3/20 1.00
TP53 P04637 3/20 0.50
HSD17B10 Q99714 2/20 0.44
IDO1 P14902 2/20 0.39
ALDH1A1 P00352 1/20 0.39
CYP1A2 P05177 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
CASP1 P29466 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
AHR P35869 1/20 0.38
LMNA P02545 1/20 0.37
HTT P42858 1/20 0.37
CASR P41180 1/20 0.36
GABRA1 P14867 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35

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
SCHEMBL29402968 1.00 TSHR (1.00) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL4465602 0.84 TSHR (0.73) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL11683376 0.81 TSHR (0.68) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL11869739 0.80 TSHR (0.65) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL30965839 0.79 TSHR (0.65) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL7943012 0.79 TSHR (0.65) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL10907163 0.78 TSHR (0.64) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL8425257 0.77 TSHR (0.65) TSHRCYP3A4TDP1MAPK1LMNA
SCHEMBL29403188 0.77 TSHR (0.62) TSHRCYP3A4TDP1MAPK1TP53
SCHEMBL799844 0.77 TSHR (0.62) TSHRCYP3A4TDP1MAPK1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743438-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS Aarti Industries Limited (IN) 2026-05-20 EP claimed
WO-2025068995-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE BENZOTRICHLORIDE COMPOUNDS AARTI INDUSTRIES LIMITED (IN) 2025-04-03 WO claimed
CN-110655447-A Preparation method of 2, 4-dichlorotrifluorotoluene 江苏丰华化学工业有限公司 2020-01-07 CN claimed
CN-101037386-A Synthesizing method of chloride JIANGSU QIANGSHENG CHEMICAL CO (CN) 2007-09-19 CN claimed
US-6313337-B1 Method of making benzoyl halides and nitriles OCCIDENTAL CHEMICAL CORPORATION 2001-11-06 US claimed
WO-2001079148-A2 METHOD OF MAKING BENZOYL HALIDES AND NITRILES AMERICAN WRECKING CORPORATION OF NEW JERSEY (US) 2001-10-25 WO claimed
US-4383116-A Process for producing 4-benzoylpyrazoles ISHIHARA SANGYO KAISHA LTD. (JP) 1983-05-10 US claimed
US-4013817-A HALOGENATED AROMATIC HYDROCARBON BRIDGESTONE TIRE COMPANY LIMITED (JA) 1977-03-22 US claimed
JP-55066538-A None JP disclosed
EP-4665705-A1 A PROCESSES FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE CORRESPONDING BENZOTRICHLORIDE COMPOUNDS Aarti Industries Limited (IN) 2025-12-24 EP disclosed
WO-2024171098-A1 A PROCESSES FOR THE PREPARATION OF BENZONITRILE COMPOUNDS FROM THE CORRESPONDING BENZOTRICHLORIDE COMPOUNDS AARTI INDUSTRIES LIMITED (IN) 2024-08-22 WO disclosed
CN-118221496-A Synthesis method of polysubstituted (trichloromethyl) benzene derivative 浙江工业大学 2024-06-21 CN disclosed
CN-114249644-B 2, 4-dichlorobenzoyl chloride production method and tail gas treatment process 江苏万隆化学有限公司 2024-01-30 CN disclosed
CN-114105726-B Preparation method of 2, 4-dichloro benzotrifluoride 江苏三美化工有限公司 2024-01-19 CN disclosed
US-4080392-A CONVERTING THE CORRESPONDING TRICHLOROMETHYL COMPOUND WITH HYDROGEN FLUORIDE, ANTIMONY PENTACHLORIDE CATALYST LONZA LTD. (CH) 1978-03-21 US disclosed
US-4054612-A HOMO- OR COPOLYMERIZATION OF BUTADIENE, CATALYTIC SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-10-18 US disclosed
US-4052473-A OF ISOPRENE, NICKEL-ALKYLAMUMIN HALIDE CONTAINING CATALYST SUMITOMO CHEMICAL COMPANY, LIMITED (JA) 1977-10-04 US disclosed
US-4046656-A Photochlorination process for methyl aromatic compounds THE DOW CHEMICAL COMPANY (US) 1977-09-06 US disclosed
US-4013817-A HALOGENATED AROMATIC HYDROCARBON BRIDGESTONE TIRE COMPANY LIMITED (JA) 1977-03-22 US disclosed
US-3952065-A ACTIVATED CARBON-PHOSPHORUS HALIDE OR AZO CATALYST, DECOMPOSITION VYSKUMNY USTAV AGROCHEMICKEJ TECHNOLOGIE (CS) 1976-04-20 US disclosed