SCHEMBL1799462

SCHEMBL1799462

Fc1c(Cl)cc(I)cc1C(F)(F)F

nearest known ligand 0.32

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 2/20 0.32
IDO1 P14902 2/20 0.31
HTR3E A5X5Y0 1/20 0.31
HTR3B O95264 1/20 0.31
HTR3A P46098 1/20 0.31
HTR3D Q70Z44 1/20 0.31
HTR3C Q8WXA8 1/20 0.31
KDR P35968 1/20 0.31
HTR2C P28335 3/20 0.30

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
SCHEMBL1796084 0.78 MAP2K1 (0.32) IDO1
SCHEMBL9691797 0.77 ALDH1A1 (0.38) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL7929426 0.77 NOTUM (0.34) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL977694 0.77 ADRB2 (0.42) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL7071048 0.75 IDO1 (0.33) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL1799126 0.74 TSHR (0.43) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL29025677 0.74 KDM1A (0.33) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL19268220 0.74 RAPGEF4 (0.41) NOTUMIDO1HTR3EHTR3BHTR3A
SCHEMBL31173894 0.74 TSHR (0.43) IDO1HTR3EHTR3BHTR3AHTR3D
SCHEMBL3175500 0.73 NOTUM (0.33) NOTUMIDO1HTR3EHTR3BHTR3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240382454-A1 ANTIPARASITIC ISOXAZOLINE COMPOUNDS, LONG-ACTING INJECTABLE FORMULATIONS COMPRISING THEM, METHODS AND USES THEREOF Boehringer Ingelheim Animal Health USA Inc. (US) 2024-11-21 US disclosed
US-12083100-B1 Antiparasitic isoxazoline compounds, long-acting injectable formulations comprising them, methods and uses thereof Boehringer Ingelheim Animal Health USA Inc. (US) 2024-09-10 US disclosed
CN-115959979-A Preparation method of 3-chloro-4-fluoro-5-trifluoromethyl trifluoroacetophenone 南京正荣医药化学有限公司 2023-04-14 CN disclosed
US-11497732-B2 Antiparasitic isoxazoline compounds, long-acting injectable formulations comprising them, methods and uses thereof Boehringer Ingelheim Animal Health USA Inc. (US) 2022-11-15 US disclosed
CN-114573573-A Antiparasitic isoxazoline compounds, long-acting injectable formulations containing them, methods and uses thereof 勃林格殷格翰动物保健美国公司 2022-06-03 CN disclosed
US-11324220-B2 Process for the preparation of isoxazoline compounds Boehringer Ingelheim Animal Health USA Inc. (US) 2022-05-10 US disclosed
CN-109068651-B Antiparasitic isoxazoline compounds, long-acting injectable formulations containing them, methods and uses thereof 勃林格殷格翰动物保健美国公司 2022-03-01 CN disclosed
EP-3440062-B1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED ISOXAZOLINE COMPOUNDS - CRYSTALLINE TOLUENE SOLVATE OF (S)-AFOXOLANER BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2021-10-06 EP disclosed
EP-3419424-B1 LONG-ACTING INJECTABLE FORMULATIONS COMPRISING ANTIPARASITIC ISOXAZOLINE COMPOUNDS AND USE THEREOF BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) 2021-04-28 EP disclosed
EP-3763211-A1 ANTIPARASITIC ISOXAZOLINE COMPOUNDS, LONG-ACTING INJECTABLE FORMULATIONS COMPRISING THEM, METHODS AND USES THEREOF Boehringer Ingelheim Animal Health USA Inc. (US) 2021-01-13 EP disclosed
WO-2017176948-A1 PROCESS FOR THE PREPARATION OF ENANTIOMERICALLY ENRICHED ISOXAZOLINE COMPOUNDS - CRYSTALLINE TOLUENE SOLVATE OF (S)-AFOXOLANER MERIAL, INC. (US) 2017-10-12 WO disclosed
WO-2017147352-A1 ANTIPARASITIC ISOXAZOLINE COMPOUNDS, LONG-ACTING INJECTABLE FORMULATIONS COMPRISING THEM, METHODS AND USES THEREOF MERIAL, INC. (US) 2017-08-31 WO disclosed
US-20170239218-A1 ANTIPARASITIC ISOXAZOLINE COMPOUNDS, LONG-ACTING INJECTABLE FORMULATIONS COMPRISING THEM, METHODS AND USES THEREOF MERIAL INC. (US) 2017-08-24 US disclosed
US-8987464-B2 Isoxazoline-substituted benzamide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2015-03-24 US disclosed
US-20140135496-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-05-15 US disclosed
US-8673951-B2 Isoxazoline-substituted benzamide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2014-03-18 US disclosed
EP-1932836-B1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND HARMFUL ORGANISM-CONTROLLING AGENT NISSAN CHEMICAL IND LTD (JP) 2013-11-06 EP disclosed
US-20110144334-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-06-16 US disclosed
US-7951828-B1 Isoxazoline-substituted benzamide compound and pesticide NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2011-05-31 US disclosed
EP-1932836-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND HARMFUL ORGANISM-CONTROLLING AGENT Nissan Chemical Industries, Ltd. (JP) 2008-06-18 EP 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 (7 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-20110144334-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE OR10J3, OR51E2, ORMDL3 NOTUM 223/4885IDO1 621/4885HTR3E 2340/4885
US-12083100-B1 Antiparasitic isoxazoline compounds, long-acting injectable formulations comprising them, methods and uses thereof IL17A, MMP17, MMP1 NOTUM 1403/4885IDO1 32/4885HTR3E 3112/4885
US-20240382454-A1 ANTIPARASITIC ISOXAZOLINE COMPOUNDS, LONG-ACTING INJECTABLE FORMULATIONS COMPRISING THEM, METHODS AND USES THEREOF IL17A, MMP17, MMP1 NOTUM 1403/4885IDO1 32/4885HTR3E 3112/4885
US-11497732-B2 Antiparasitic isoxazoline compounds, long-acting injectable formulations comprising them, methods and uses thereof IL17A, MMP17, MMP1 NOTUM 1403/4885IDO1 32/4885HTR3E 3112/4885
US-20140135496-A1 ISOXAZOLINE-SUBSTITUTED BENZAMIDE COMPOUND AND PESTICIDE OR10J3, OR51E2, ODC1 NOTUM 646/4885IDO1 684/4885HTR3E 2032/4885
US-11324220-B2 Process for the preparation of isoxazoline compounds CYP3A7, CYP3A4, CYP3A5 NOTUM 2528/4885IDO1 8/4885HTR3E 1276/4885
US-20170239218-A1 ANTIPARASITIC ISOXAZOLINE COMPOUNDS, LONG-ACTING INJECTABLE FORMULATIONS COMPRISING THEM, METHODS AND USES THEREOF IL17A, MMP17, MMP1 NOTUM 1403/4885IDO1 32/4885HTR3E 3112/4885

“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.