SCHEMBL1859913

SCHEMBL1859913

CC(=O)c1ncccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 1/20 0.47
HCRTR1 O43613 1/20 0.45
HCRTR2 O43614 1/20 0.45
CTNNB1 P35222 2/20 0.45
WNT3A P56704 2/20 0.45
CNR2 P34972 1/20 0.44
GAA P10253 1/20 0.43
DHODH Q02127 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
ALDH1A1 P00352 3/20 0.41
TLR7 Q9NYK1 1/20 0.41
MAOA P21397 1/20 0.41
MAOB P27338 1/20 0.41
TRPV1 Q8NER1 6/20 0.41
HSD11B1 P28845 1/20 0.40
KDM4E B2RXH2 1/20 0.40
CYP3A4 P08684 1/20 0.40
MAPT P10636 1/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40

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
SCHEMBL1987669 0.85 NFE2L2 (0.43) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
SCHEMBL5325529 0.83 CTNNB1 (0.46) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
SCHEMBL14208205 0.83 ALDH1A1 (0.42) NFE2L2GAAALDH1A1KDM4ECYP3A4
SCHEMBL286833 0.83 KDM4E (0.55) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
SCHEMBL11919358 0.82 NFE2L2 (0.45) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
SCHEMBL3058108 0.81 CTNNB1 (0.45) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
SCHEMBL1570557 0.81 CTNNB1 (0.45) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
Hydrochloric Acid SCHEMBL3058112 0.81 KDM4E (0.53) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
SCHEMBL11920844 0.81 CTNNB1 (0.51) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A
SCHEMBL2346222 0.81 L3MBTL1 (0.55) NFE2L2HCRTR1HCRTR2CTNNB1WNT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260109671-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS INC (US) 2026-04-23 US disclosed
US-12448352-B2 Beta adrenergic agonist and methods of using the same CURASEN THERAPEUTICS, INC. (US) 2025-10-21 US disclosed
EP-4471034-A1 DISUBSTITUTED OCTAHYDROPYRROLO[3,4-C]PYRROLE METHYL KETONE DERIVATIVE AND APPLICATION THEREOF Jiangsu NHWA Pharmaceutical Co., Ltd (CN) 2024-12-04 EP disclosed
CN-118556061-A Disubstituted octahydropyrrolo [3,4-c ] pyrrole methyl ketone derivative and application thereof 江苏恩华药业股份有限公司 2024-08-27 CN disclosed
WO-2024109672-A1 DISUBSTITUTED OCTAHYDROPYRROLO[3,4-C]PYRROLE METHYL KETONE DERIVATIVE AND APPLICATION THEREOF 江苏恩华药业股份有限公司 2024-05-30 WO disclosed
CN-116056576-A Use of strobilurin type compounds for combating phytopathogenic fungi containing F129L amino acid substitutions conferring tolerance to Qo inhibitor VIII in mitochondrial cytochrome b proteins 巴斯夫欧洲公司 2023-05-02 CN disclosed
US-20220169612-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. 2022-06-02 US disclosed
US-20220169612-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME CURASEN THERAPEUTICS, INC. 2022-06-02 US disclosed
EP-3946329-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME Curasen Therapeutics, Inc. (US) 2022-02-09 EP disclosed
CN-114007615-A Beta adrenergic agonists and methods of use thereof 库拉森疗法公司 2022-02-01 CN disclosed
WO-2006042289-A2 SUBSTITUTED BIARYL QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2006-04-20 WO disclosed
EP-1644372-A2 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2006-04-12 EP disclosed
EP-1625119-A1 SUBSTITUTED-1-PHTHALAZINAMINES AS VR-1 ANTAGONISTS MERCK SHARP & DOHME LTD. (GB) 2006-02-15 EP disclosed
EP-1597261-A1 SUBSTITUTED AMINO HETEROCYCLES AS VR-1 ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME LTD. (GB) 2005-11-23 EP disclosed
US-20050215575-A1 (4-Isopropyl-phenyl)-[2-(tetrahydro-pyran-4-yloxymethyl)-7-(3-trifluoromethyl-pyridin-2-yl)-quinazolin-4-yl]-amine; 2-{4-[2-benzyloxymethyl-7-(3-trifluoromethyl-pyridin-2-yl)-quinazolin-4-ylamino]-phenyl}-2-methyl-propionitrile; treating conditions related to capsaicin receptor activation NEUROGEN CORPORATION 2005-09-29 US disclosed
WO-2005087227-A1 ARYLALKYLAMINO-SUBSTITUTED QUINAZOLINE ANALOGUES NEUROGEN CORPORATION (US) 2005-09-22 WO disclosed
US-20050070547-A1 Substituted quinolin-4-ylamine analogues NEUROGEN CORPORATION 2005-03-31 US disclosed
WO-2005007652-A2 SUBSTITUTED QUINOLIN-4-YLAMINE ANALOGUES NEUROGEN CORPORATION (US) 2005-01-27 WO disclosed
WO-2004099177-A1 SUBSTITUTED-1-PHTHALAZINAMINES AS VR-1 ANTAGONISTS MERCK SHARP & DOHME LIMITED (GB) 2004-11-18 WO disclosed
WO-2004074290-A1 SUBSTITUTED AMINO HETEROCYCLES AS VR-1 ANTAGONISTS FOR TREATING PAIN MERCK SHARP & DOHME LIMITED (GB) 2004-09-02 WO 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 (5 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-12448352-B2 Beta adrenergic agonist and methods of using the same ADRA2B, ADRB2, ADRB1 NFE2L2 2763/4885HCRTR1 460/4885HCRTR2 445/4885
US-20050215575-A1 (4-Isopropyl-phenyl)-[2-(tetrahydro-pyran-4-yloxymethyl)-7-(3-trifluoromethyl-pyridin-2-yl)-quinazolin-4-yl]-amine; 2-{4-[2-benzyloxymethyl-7-(3-trifluoromethyl-pyridin-2-yl)-quinazolin-4-ylamino]-phenyl}-2-methyl-propionitrile; treating conditions related to capsaicin receptor activation TRPV1, CNR2, NTRK1 NFE2L2 3640/4885HCRTR1 909/4885HCRTR2 591/4885
US-20050070547-A1 Substituted quinolin-4-ylamine analogues PIGS, HRH4, GPR52 NFE2L2 3204/4885HCRTR1 618/4885HCRTR2 367/4885
US-20260109671-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRB2, ADRB1, ADRA2C NFE2L2 2165/4885HCRTR1 138/4885HCRTR2 55/4885
US-20220169612-A1 BETA ADRENERGIC AGONIST AND METHODS OF USING THE SAME ADRA2B, ADRB2, ADRB1 NFE2L2 2763/4885HCRTR1 460/4885HCRTR2 445/4885

“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.