SCHEMBL29635307

SCHEMBL29635307

CN(C)C(=O)Nc1cc(-c2cc(-c3ccccc3C(F)(F)F)[nH]c(=O)c2)ccn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PIK3C3 Q8NEB9 11/20 1.00
GSK3A P49840 1/20 0.38
GSK3B P49841 1/20 0.38
KIT P10721 1/20 0.38
CYP3A4 P08684 2/20 0.37
AAK1 Q2M2I8 2/20 0.37
EEF2K O00418 1/20 0.37
PLK1 P53350 1/20 0.37
NR3C2 P08235 1/20 0.36
SCN9A Q15858 1/20 0.36
BUB1 O43683 1/20 0.36

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
SCHEMBL22408453 1.00 PIK3C3 (1.00) PIK3C3GSK3AGSK3BKITCYP3A4
SCHEMBL20774921 0.89 PIK3C3 (0.80) PIK3C3CYP3A4AAK1
SCHEMBL26612404 0.88 PIK3C3 (0.79) PIK3C3GSK3AGSK3BKITNR3C2
SCHEMBL20764978 0.87 PIK3C3 (0.78) PIK3C3CYP3A4AAK1
SCHEMBL20765267 0.85 PIK3C3 (0.74) PIK3C3GSK3B
SCHEMBL20764777 0.83 PIK3C3 (1.00) PIK3C3GSK3AGSK3B
SCHEMBL29035847 0.81 PIK3C3 (0.71) PIK3C3KITCYP3A4
SCHEMBL29701003 0.79 PIK3C3 (0.77) PIK3C3
SCHEMBL20765374 0.79 PIK3C3 (0.77) PIK3C3
SCHEMBL20765560 0.77 PIK3C3 (1.00) PIK3C3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4384180-A1 COMBINATION THERAPY OF VPS34 INHIBITORS AND STING AGONIST FOR USE IN THE TREATMENT OF CANCER Deciphera Pharmaceuticals, LLC (US) 2024-06-19 EP claimed
CN-118201619-A Combination therapy of VPS34 inhibitors with STING agonists for the treatment of cancer 德西费拉制药有限责任公司 2024-06-14 CN claimed
CN-117083064-A Pyridinylpyridone derivatives as VPS34 inhibitors for the treatment of viral infections 德西费拉制药有限责任公司 2023-11-17 CN claimed
EP-4251152-A1 PYRIDYLPYRIDONE DERIVATIVES AS VSP34 INHIBITORS FOR USE IN THE TREATMENT OF A VIRAL INFECTION Deciphera Pharmaceuticals, LLC (US) 2023-10-04 EP claimed
CN-111094244-B Pyridinylpyridinone compounds 思普瑞特生物科学公司 2023-07-11 CN claimed
WO-2023019259-A1 COMBINATION THERAPY OF VPS34 INHIBITORS AND STING AGONIST FOR USE IN THE TREATMENT OF CANCER DECIPHERA PHARMACEUTICALS, LLC (US) 2023-02-16 WO claimed
US-20220184050-A1 ANTI-VIRAL ACTIVITY OF VPS34 INHIBITORS DECIPHERA PHARMACEUTICALS, LLC 2022-06-16 US claimed
WO-2022115545-A1 PYRIDYLPYRIDONE DERIVATIVES AS VSP34 INHIBITORS FOR USE IN THE TREATMENT OF A VIRAL INFECTION DECIPHERA PHARMACEUTICALS, LLC (US) 2022-06-02 WO claimed
EP-4384180-A1 COMBINATION THERAPY OF VPS34 INHIBITORS AND STING AGONIST FOR USE IN THE TREATMENT OF CANCER Deciphera Pharmaceuticals, LLC (US) 2024-06-19 EP disclosed
CN-118201619-A Combination therapy of VPS34 inhibitors with STING agonists for the treatment of cancer 德西费拉制药有限责任公司 2024-06-14 CN disclosed
CN-117083064-A Pyridinylpyridone derivatives as VPS34 inhibitors for the treatment of viral infections 德西费拉制药有限责任公司 2023-11-17 CN disclosed
CN-116903526-A Pyridinylpyridinone compounds 思普瑞特生物科学公司 2023-10-20 CN disclosed
CN-116891431-A Pyridinylpyridinone compounds 思普瑞特生物科学公司 2023-10-17 CN disclosed
EP-4251152-A1 PYRIDYLPYRIDONE DERIVATIVES AS VSP34 INHIBITORS FOR USE IN THE TREATMENT OF A VIRAL INFECTION Deciphera Pharmaceuticals, LLC (US) 2023-10-04 EP disclosed
CN-111094244-B Pyridinylpyridinone compounds 思普瑞特生物科学公司 2023-07-11 CN disclosed
WO-2023019259-A1 COMBINATION THERAPY OF VPS34 INHIBITORS AND STING AGONIST FOR USE IN THE TREATMENT OF CANCER DECIPHERA PHARMACEUTICALS, LLC (US) 2023-02-16 WO disclosed
US-20220184050-A1 ANTI-VIRAL ACTIVITY OF VPS34 INHIBITORS DECIPHERA PHARMACEUTICALS, LLC 2022-06-16 US disclosed
WO-2022115545-A1 PYRIDYLPYRIDONE DERIVATIVES AS VSP34 INHIBITORS FOR USE IN THE TREATMENT OF A VIRAL INFECTION DECIPHERA PHARMACEUTICALS, LLC (US) 2022-06-02 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 (1 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-20220184050-A1 ANTI-VIRAL ACTIVITY OF VPS34 INHIBITORS SARS1, VPS26B, VPS4B PIK3C3 1967/4885GSK3A 4067/4885GSK3B 3686/4885

“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.