SCHEMBL165097

SCHEMBL165097

NCCc1ccc(Cl)nc1

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.52
KDM4E B2RXH2 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
PNMT P11086 1/20 0.47
MAOB P27338 1/20 0.45
CHRNA7 P36544 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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 SCHEMBL14157130 0.98 TAAR1 (0.50) TAAR1KDM4EGAAMAPTL3MBTL1
SCHEMBL8196044 0.88 CYP2A6 (0.48) KDM4EGAAMAPTL3MBTL1ALDH1A1
SCHEMBL19797822 0.83 GAA (0.47) KDM4EGAAMAPTL3MBTL1ALDH1A1
SCHEMBL137992 0.82
SCHEMBL10483901 0.81 SIGMAR1 (0.56) KDM4EGAAMAPTL3MBTL1
Hydrochloric Acid SCHEMBL5013501 0.80 GAA (0.48) KDM4EGAAMAPTL3MBTL1CHRNA7
SCHEMBL10483958 0.80 GAA (0.48) KDM4EGAAMAPTL3MBTL1ALDH1A1
Hydrochloric Acid SCHEMBL3346503 0.80 GAA (0.48) KDM4EGAAMAPTL3MBTL1CHRNA7
Hydrochloric Acid SCHEMBL28045785 0.80 GAA (0.48) KDM4EGAAMAPTL3MBTL1CHRNA7
SCHEMBL10483903 0.79 SIGMAR1 (0.49) KDM4EGAAMAPTL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9737875-B2 Affinity reagents for protein purification IMPOSSIBLE FOODS INC. (US) 2017-08-22 US claimed
CN-106699646-A Synthetic method of acetamiprid 江苏长青生物科技有限公司 2017-05-24 CN claimed
CN-118265702-A Microbiocidal isonicotinamide derivatives 先正达农作物保护股份公司 2024-06-28 CN disclosed
WO-2023166067-A1 MICROBIOCIDAL PYRIDAZINONE AMIDE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-09-07 WO disclosed
WO-2023118011-A1 MICROBIOCIDAL AZA-HETEROBIARYL DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-06-29 WO disclosed
WO-2023089049-A2 MICROBIOCIDAL ISONICOTINIC AMIDE DERIVATIVES SYNGENTA CROP PROTECTION AG (CH) 2023-05-25 WO disclosed
US-20200392126-A1 ISOXAZOLYL COMPOUNDS AS RECEPTOR MODULATING COMPOUNDS AND METHODS AND USES THEREOF BIONOMICS LIMITED (AU) 2020-12-17 US disclosed
WO-2019109132-A1 ISOXAZOLYL COMPOUNDS AS RECEPTOR MODULATING COMPOUNDS AND METHODS AND USES THEREOF BIONOMICS LIMITED (AU) 2019-06-13 WO disclosed
US-10085449-B2 N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-2,2,2- trifluoroacetamide for control of agricultural/horticultural pests MEIJI SEIKA PHARMA CO., LTD. (JP) 2018-10-02 US disclosed
US-20170360041-A1 N-[1-((6-CHLOROPYRIDIN-3-YL)METHYL)PYRIDIN-2(1H)-YLIDENE]-2,2,2- TRIFLUOROACETAMIDE FOR CONTROL OF AGRICULTURAL/HORTICULTURAL PESTS MEIJI SEIKA PHARMA CO., LTD. (JP) 2017-12-21 US disclosed
US-9717242-B2 N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-2,2,2-trifluoroacetamide for control of agricultural/horticultural pests MEIJI SEIKA PHARMA CO., LTD. (JP) 2017-08-01 US disclosed
WO-2008144222-A2 TRIAZOLYL AMINOPYRIMIDINE COMPOUNDS ELI LILLY AND COMPANY (US) 2008-11-27 WO disclosed
WO-2008079346-A1 5-CYAN0-4- (PYRROLO [2, 3B] PYRIDINE-3-YL) -PYRIMIDINE DERIVATIVES USEFUL AS PROTEIN KINASE INHIBITORS VERTEX PHARMACEUTICALS INCORPORATED (US) 2008-07-03 WO disclosed
WO-2008076705-A1 IMIDAZOLIDINONYL AMINOPYRIMIDINE COMPOUNDS FOR THE TREATMENT OF CANCER ELI LILLY AND COMPANY (US) 2008-06-26 WO disclosed
US-20080033020-A1 3-Pyridinylethylbenzamide Derivatives as Fungicides BAYER CROPSCIENCE S.A. (FR) 2008-02-07 US disclosed
EP-1773776-A1 3-PYRIDINYLETHYLBENZAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2007-04-18 EP disclosed
WO-2006008191-A1 3-PYRIDINYLETHYLBENZAMIDE DERIVATIVES AS FUNGICIDES BAYER CROPSCIENCE SA (FR) 2006-01-26 WO disclosed
US-4410530-A CARDIO-SELECTIVE B-RECEPTOR BLOCKING AGENTS AND STIMULANTS CIBA-GEIGY CORPORATION (US) 1983-10-18 US disclosed
US-4195090-A ADRENERGIC BLOCKING AGENTS CIBA-GEIGY CORPORATION (US) 1980-03-25 US disclosed
US-4115575-A CARDIOVASCULAR DISORDERS CIBA-GEIGY CORPORATION (US) 1978-09-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (4 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080033020-A1 3-Pyridinylethylbenzamide Derivatives as Fungicides CYP1A2, CYP4B1, CYP4F2 TAAR1 3735/4885KDM4E 1303/4885GAA 122/4885
US-20200392126-A1 ISOXAZOLYL COMPOUNDS AS RECEPTOR MODULATING COMPOUNDS AND METHODS AND USES THEREOF CHRNA7, CHRNA5, CHRNA1 TAAR1 321/4885KDM4E 2639/4885GAA 1391/4885
US-10085449-B2 N-[1-((6-chloropyridin-3-yl)methyl)pyridin-2(1H)-ylidene]-2,2,2- trifluoroacetamide for control of agricultural/horticultural pests NR2E1, CROCC, PRMT1 TAAR1 72/4885KDM4E 95/4885GAA 4426/4885
US-20170360041-A1 N-[1-((6-CHLOROPYRIDIN-3-YL)METHYL)PYRIDIN-2(1H)-YLIDENE]-2,2,2- TRIFLUOROACETAMIDE FOR CONTROL OF AGRICULTURAL/HORTICULTURAL PESTS NR2E1, CROCC, PRMT1 TAAR1 72/4885KDM4E 95/4885GAA 4426/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.