SCHEMBL8948329

SCHEMBL8948329

COC(=O)C(Br)C(F)(F)F

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
ZDHHC7 Q9NXF8 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
ACHE P22303 1/20 0.35
CA14 Q9ULX7 2/20 0.34
CA12 O43570 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.31
HSD17B10 Q99714 1/20 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
SCHEMBL21598012 0.85 SMN1; SMN2 (0.37) SMN1; SMN2ZDHHC7CA1CA2ACHE
SCHEMBL28301320 0.79 SMN1; SMN2 (0.42) SMN1; SMN2ZDHHC7CA1CA2CA14
SCHEMBL11287379 0.79 SMN1; SMN2 (0.40) SMN1; SMN2ZDHHC7CA1CA2CA14
SCHEMBL30170510 0.79 SMN1; SMN2 (0.42) SMN1; SMN2ZDHHC7CA1CA2CA14
SCHEMBL27964961 0.78 ALDH1A1 (0.40) KMT2AALDH1A1HTTHSD17B10
SCHEMBL11320047 0.77 SMN1; SMN2 (0.39) SMN1; SMN2ZDHHC7CA1CA2CA14
SCHEMBL1241162 0.76 SMN1; SMN2 (0.42) SMN1; SMN2ZDHHC7CA1CA2ACHE
SCHEMBL3140450 0.76 SMN1; SMN2 (0.42) SMN1; SMN2ZDHHC7CA1CA2ACHE
SCHEMBL23130631 0.74 SMN1; SMN2 (0.42) SMN1; SMN2CA1CA2ACHECA14
SCHEMBL197319 0.74 SMN1; SMN2 (0.40) SMN1; SMN2ZDHHC7CA1CA2ACHE

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61205234-A None JP disclosed
EP-4648762-A2 PPARG MODULATORS University of Florida Research Foundation, Incorporated (US) 2025-11-19 EP disclosed
WO-2024151519-A2 PPARG MODULATORS UNIVERSITY OF FLORIDA RESEARCH FOUNDATIN, INCORPORATED (US) 2024-07-18 WO disclosed
EP-3444254-B1 HETEROCYCLIC-SUBSTITUTED PYRIDINOPYRIMIDINONE DERIVATIVE AS CDK INHIBITOR AND USE THEREOF SHANGHAI XUNHE PHARMACEUTICAL TECH CO LTD (CN) 2020-05-13 EP disclosed
US-10351578-B2 Heterocyclic-substituted pyridinopyrimidinone derivative as CDK inhibitor and use thereof Shanghai Xunhe Pharmaceutical Technology Co. Ltd. (CN) 2019-07-16 US disclosed
CN-107286180-B Miscellaneous generation Pyridopyrimidinone derivatives are as CDK inhibitor and its application 上海勋和医药科技有限公司 2019-07-02 CN disclosed
US-20190071453-A1 Heterocyclic-substituted Pyridinopyrimidinone Derivative as CDK Inhibitor and Use thereof CHENGDU JINRUI FOUNDATION BIOTECH CO., LTD. (CN) 2019-03-07 US disclosed
EP-3444254-A1 HETEROCYCLIC-SUBSTITUTED PYRIDINOPYRIMIDINONE DERIVATIVE AS CDK INHIBITOR AND USE THEREOF Shanghai Xunhe Pharmaceutical Technology Co., Ltd. (CN) 2019-02-20 EP disclosed
CN-107286180-A Miscellaneous generation Pyridopyrimidinone derivatives are used as CDK inhibitor and its application 上海勋和医药科技有限公司 2017-10-24 CN disclosed
US-20150011528-A1 PHENYLIMIDE-CONTAINING BENZOTHIAZOLE DERIVATIVE OF ITS SALT AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME YUHAN CORPORATION (KR) 2015-01-08 US disclosed
EP-2758384-A1 PHENYLIMIDE-CONTAINING BENZOTHIAZOLE DERIVATIVE OR ITS SALT AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Yuhan Corporation (KR) 2014-07-30 EP disclosed
WO-2013043001-A1 PHENYLIMIDE-CONTAINING BENZOTHIAZOLE DERIVATIVE OR ITS SALT AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME YUHAN CORPORATION (KR) 2013-03-28 WO disclosed
CN-100506807-C Amide derivatives as GK activators NOVO NORDISK AS (DK) 2009-07-01 CN disclosed
CN-101434585-A Amide derivatives as GK activators NOVO NORDISK AS (DK) 2009-05-20 CN disclosed
CN-1658871-A Amide derivatives as GK activators NOVO NORDISK AS (DK) 2005-08-24 CN disclosed
US-5585391-A Hydroxyl ions as unique therapeutic agents and compounds that modulate these ions, compositions employing these agents, therapeutic methods for using such agents and processes for preparing them FHJ SCIENTIFIC, INC. (US) 1996-12-17 US disclosed
US-5574050-A Hydroxyl ions as unique therapeutic agents and processes for preparing them FHJ SCIENTIFIC, INC. (US) 1996-11-12 US disclosed
US-5514808-A Hydroxyl ions as unique therapeutic agents and compounds that modulate these ions FHJ SCIENTIFIC, INC (US) 1996-05-07 US disclosed
JP-S61205234-A FLUORINE-CONTAINING HYDROXYCARBOXYLIC ACID ESTER DAIKIN IND LTD 1986-09-11 JP 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 (3 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-20190071453-A1 Heterocyclic-substituted Pyridinopyrimidinone Derivative as CDK Inhibitor and Use thereof CDK4, CDK6, CCNI SMN1; SMN2 2217/4885ZDHHC7 4063/4885CA1 4698/4885
US-10351578-B2 Heterocyclic-substituted pyridinopyrimidinone derivative as CDK inhibitor and use thereof CDK4, CDK6, CCNI SMN1; SMN2 2217/4885ZDHHC7 4063/4885CA1 4698/4885
US-20150011528-A1 PHENYLIMIDE-CONTAINING BENZOTHIAZOLE DERIVATIVE OF ITS SALT AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME ILK, PKMYT1, PLAUR SMN1; SMN2 2126/4885ZDHHC7 3449/4885CA1 4715/4885

“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.