SCHEMBL4015276

SCHEMBL4015276

CN(C(=O)OC(C)(C)C)c1ccc(Br)cc1F

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SIRT2 Q8IXJ6 2/20 0.43
AAK1 Q2M2I8 3/20 0.41
USP30 Q70CQ3 1/20 0.40
DGAT1 O75907 1/20 0.38
NCEH1 Q6PIU2 1/20 0.37
ALDH1A1 P00352 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
NPC1 O15118 3/20 0.36
FPR2 P25090 1/20 0.35
SSTR4 P31391 1/20 0.35
PDK2 Q15119 4/20 0.35
RAB9A P51151 2/20 0.35
ABL1 P00519 1/20 0.35
LMNA P02545 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
ALOX12 P18054 1/20 0.35

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
SCHEMBL19003377 0.86 AAK1 (0.41) AAK1NCEH1ALDH1A1L3MBTL1NPC1
SCHEMBL30175909 0.86 AAK1 (0.41) AAK1NCEH1ALDH1A1L3MBTL1NPC1
SCHEMBL20671184 0.84 AAK1 (0.40) AAK1NCEH1ALDH1A1L3MBTL1NPC1
SCHEMBL22439649 0.84 PDK2 (0.46) SSTR4PDK2ABL1
SCHEMBL30116140 0.84 AAK1 (0.40) AAK1NCEH1ALDH1A1L3MBTL1NPC1
SCHEMBL17427750 0.83 SIRT2 (0.45) SIRT2DGAT1NCEH1ALDH1A1L3MBTL1
SCHEMBL3987633 0.83 USP30 (0.41) SIRT2AAK1USP30DGAT1NCEH1
SCHEMBL18157853 0.82 ABL1 (0.37) AAK1PDK2ABL1
SCHEMBL30370098 0.82 ABL1 (0.37) AAK1PDK2ABL1
SCHEMBL27634058 0.82 AAK1 (0.49) AAK1NCEH1ALDH1A1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743453-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION Pretzel Therapeutics, Inc. (US) 2026-05-20 EP disclosed
WO-2025015178-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2025-01-16 WO disclosed
CN-118702683-A Phenyl ethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, compositions and methods thereof 凌科药业(杭州)有限公司 2024-09-27 CN disclosed
US-12024503-B2 Benzethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-07-02 US disclosed
US-12024503-B2 Benzethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-07-02 US disclosed
US-12024503-B2 Benzethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-07-02 US disclosed
CN-113993861-B Phenyl ethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, compositions and methods thereof 凌科药业(杭州)有限公司 2024-05-14 CN disclosed
US-20240083882-A1 BENZETHERS AND ANILINES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2024-03-14 US disclosed
WO-2020206588-A1 BENZETHERS AND ANILINES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO., LTD. (CN) 2020-10-15 WO disclosed
WO-2020207414-A1 BENZETHERS AND ANILINES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF LYNK PHARMACEUTICALS CO. LTD. (CN) 2020-10-15 WO disclosed
CN-100348609-C Glucocorticoid receptor ligands for the treatment of metabolic disorders KAROBIO AB (SE) 2007-11-14 CN disclosed
US-20070027117-A1 Novel glucocorticoid receptor ligands for the treatment of metabolic disorders BISHOP RICHARD D 2007-02-01 US disclosed
US-20070027117-A1 Novel glucocorticoid receptor ligands for the treatment of metabolic disorders BISHOP RICHARD D 2007-02-01 US disclosed
US-20070027117-A1 Novel glucocorticoid receptor ligands for the treatment of metabolic disorders BISHOP RICHARD D 2007-02-01 US disclosed
US-7141559-B2 Glucocorticoid receptor ligands for the treatment of metabolic disorders KARO BIO AB (SE) 2006-11-28 US disclosed
EP-1551860-B1 GLUCOCORTICOID RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS KAROBIO AB (SE) 2006-11-22 EP disclosed
CN-1662549-A Glucocorticoid receptor ligands for the treatment of metabolic disorders KAROBIO AB (SE) 2005-08-31 CN disclosed
EP-1551860-A1 GLUCOCORTICOID RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS KARO BIO AB (SE) 2005-07-13 EP disclosed
US-20040235810-A1 Novel glucocorticoid receptor ligands for the treatment of metabolic disorders ABBOTT LABORATORIES 2004-11-25 US disclosed
WO-2004000869-A1 GLUCOCORTICOID RECEPTOR LIGANDS FOR THE TREATMENT OF METABOLIC DISORDERS KARO BIO AB (SE) 2003-12-31 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 (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-12024503-B2 Benzethers and anilines of pyrazolyl-amino-pyrimidinyl derivatives, and compositions and methods thereof JAK3, JAK1, JAK2 SIRT2 2361/4885AAK1 510/4885USP30 2195/4885
US-20070027117-A1 Novel glucocorticoid receptor ligands for the treatment of metabolic disorders GPR119, NR3C1, INSR SIRT2 2921/4885AAK1 1603/4885USP30 2263/4885
US-20040235810-A1 Novel glucocorticoid receptor ligands for the treatment of metabolic disorders GPR119, NR3C1, INSR SIRT2 2921/4885AAK1 1603/4885USP30 2263/4885
US-20240083882-A1 BENZETHERS AND ANILINES OF PYRAZOLYL-AMINO-PYRIMIDINYL DERIVATIVES, AND COMPOSITIONS AND METHODS THEREOF JAK3, JAK1, JAK2 SIRT2 2297/4885AAK1 504/4885USP30 2210/4885

“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.