SCHEMBL112183

SCHEMBL112183

C=C(c1cc(Cl)cc(Cl)c1)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TPMT P51580 1/20 0.41
TSHR P16473 1/20 0.38
RAB9A P51151 1/20 0.33
CYP3A4 P08684 2/20 0.32
MEN1 O00255 1/20 0.32
PLA2G1B P04054 1/20 0.32
CYP1A2 P05177 1/20 0.32
GAA P10253 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ATG4B Q9Y4P1 1/20 0.32
AHR P35869 1/20 0.31
HCAR1 Q9BXC0 1/20 0.31
GRN P28799 1/20 0.31
SORT1 Q99523 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL869926 0.87 TAS1R3 (0.35) TPMT
SCHEMBL16688213 0.86 RAPGEF4 (0.33) TPMT
SCHEMBL570091 0.86 CES2 (0.41) CYP3A4MEN1PLA2G1BCYP1A2GAA
SCHEMBL2010985 0.86 NOTUM (0.31) TPMT
SCHEMBL24145139 0.86 TPMT (0.30) TPMT
SCHEMBL2033922 0.84 TPMT (0.39) TPMTTSHRRAB9ACYP3A4MEN1
SCHEMBL15195896 0.82 AHR (0.33) RAB9AAHR
SCHEMBL14956056 0.82 TPMT (0.38) TPMTTSHRRAB9ACYP3A4MEN1
SCHEMBL113435 0.79 HPGD (0.39) TSHRCYP3A4AHR
SCHEMBL112191 0.79 PARP1 (0.47) TSHRRAB9AGAACYP2C19KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118652221-A Isoxazoline compound and preparation and application thereof 上海应用技术大学 2024-09-17 CN claimed
CN-115246825-B Isoxazoline derivative containing amide structure, preparation method thereof and application of isoxazoline derivative as insecticidal and bactericidal agent 瑞普(天津)生物药业有限公司 2024-06-07 CN claimed
CN-114907236-B Aldoxime compound and preparation method and application thereof 四川青木制药有限公司 2024-02-09 CN claimed
CN-115246795-B Isoxazoline compound containing ether structure at 4-phenyl para-position, preparation method thereof and application thereof as insecticidal and bactericidal agent 瑞普(天津)生物药业有限公司 2024-01-02 CN claimed
CN-116640100-A Solid-phase synthesis method of fluororalrana 河北圣雪大成制药有限责任公司 2023-08-25 CN claimed
CN-113759052-B Method for detecting related substances in fluorine Lei Lana initiator 丽珠集团新北江制药股份有限公司 2023-05-23 CN claimed
CN-113899833-B Determination of 1, 3-dichloro-5- (1-trifluoromethyl-vinyl) benzene by gas chromatography 丽珠集团新北江制药股份有限公司 2023-05-23 CN claimed
CN-113759044-B Method for detecting fluorine Lei Lana starter by reversed-phase HPLC 丽珠集团新北江制药股份有限公司 2023-05-23 CN claimed
CN-116102511-A Preparation method of high-purity fluorine Lei Lana intermediate 河北圣雪大成制药有限责任公司 2023-05-12 CN claimed
CN-116041212-A Preparation and application of difluoro olefin ether and oxime ether derivatives 安徽农业大学 2023-05-02 CN claimed
CN-115246826-A Quaternary ammonium salt isoxazoline compound, preparation thereof and application thereof as insecticide and bactericide 瑞普(天津)生物药业有限公司 2022-10-28 CN claimed
CN-115246795-A Isoxazoline compound with 4-phenyl para-position containing ether structure, preparation thereof and application thereof as insecticide and bactericide 瑞普(天津)生物药业有限公司 2022-10-28 CN claimed
CN-115246825-A Isoxazoline derivative containing amide structure, preparation thereof and application of isoxazoline derivative as insecticide and bactericide 瑞普(天津)生物药业有限公司 2022-10-28 CN claimed
CN-114907236-A Aldoxime compound and preparation method and application thereof 四川青木制药有限公司 2022-08-16 CN claimed
CN-114394946-A Synthesis method of flurarana 艾美科健(中国)生物医药有限公司 2022-04-26 CN claimed
CN-113899833-A Determination of 1, 3-dichloro-5- (1-trifluoromethyl-vinyl) benzene by gas chromatography 丽珠集团新北江制药股份有限公司 2022-01-07 CN claimed
CN-113773312-A Novel isoxazoline derivative and preparation method and application thereof 河南牧业经济学院 2021-12-10 CN claimed
CN-113759044-A Method for detecting frainer initiator by reversed-phase HPLC 丽珠集团新北江制药股份有限公司 2021-12-07 CN claimed
CN-113759052-A Method for detecting related substances in frataxin initiator 丽珠集团新北江制药股份有限公司 2021-12-07 CN claimed
CN-111308002-A Method for detecting isoxazoline insecticide and impurities thereof 丽珠集团新北江制药股份有限公司 2020-06-19 CN claimed