SCHEMBL29410282

SCHEMBL29410282

CNc1nc(-c2ccc3c(N)n[nH]c3c2)cc(N2C[C@@H](C(=O)NC3CCCCC3)CC[C@H]2C)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 20/20 1.00
AURKB Q96GD4 19/20 1.00
AURKA O14965 12/20 1.00
ROCK1 Q13464 9/20 1.00
PIK3CG P48736 1/20 1.00
PDK1 Q15118 1/20 1.00
TGFBR1 P36897 2/20 0.63

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
SCHEMBL1317022 1.00 PDPK1 (1.00) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1317861 0.92 PDPK1 (0.86) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1320418 0.91 PDPK1 (1.00) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1319624 0.91 PDPK1 (0.98) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1318073 0.90 PDPK1 (0.82) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1318075 0.90 PDPK1 (0.82) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1318076 0.90 PDPK1 (0.82) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1316758 0.89 PDPK1 (0.81) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1316760 0.89 PDPK1 (0.81) PDPK1AURKBAURKAROCK1PIK3CG
SCHEMBL1316761 0.89 PDPK1 (0.81) PDPK1AURKBAURKAROCK1PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4605376-A1 ISOQUINOLINE DERIVATIVES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES RDP Pharma AG (CH) 2025-08-27 EP claimed
CN-120202190-A Isoquinoline derivatives as protein degrading agents, E7 degrading agents, antiviral agents, tumor therapeutic agents and immunosuppressants RDP制药股份公司 2025-06-24 CN claimed
EP-4548977-A2 NOVEL ISOQUINOLINES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES RDP Pharma AG (CH) 2025-05-07 EP claimed
WO-2025082502-A1 PAN T CELLS AND METHODS OF MANUFACTURING OF THE SAME NANJING LEGEND BIOTECH CO., LTD. (CN) 2025-04-24 WO claimed
WO-2025080080-A1 PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING PARKINSON'S DISEASE, CONTAINING PDK INHIBITOR AS ACTIVE INGREDIENT 한양대학교 산학협력단 2025-04-17 WO claimed
US-20240382484-A1 COMPOSITION FOR TREATING, PREVENTING, OR AMELIORATING MELANOMA AND METHOD THEREOF THOMAS JEFFERSON UNIVERSITY 2024-11-21 US claimed
US-12036241-B2 Compositions and methods for immune cell modulation in adoptive immunotherapies FATE THERAPEUTICS, INC. (US) 2024-07-16 US claimed
WO-2024083802-A1 ISOQUINOLINE DERIVATIVES AS PROTEIN DEGRADERS, E7 DEGRADERS, ANTIVIRALS, TUMOR THERAPEUTICS AND IMMUNE SUPPRESSIVES VALDOSPAN GMBH (AT) 2024-04-25 WO claimed
CN-111912826-B Method for evaluating efficacy of antitumor drug at cellular level 上海氘峰医疗科技有限公司 2024-03-01 CN claimed
EP-4322949-A1 ISOQUINOLINE DERIVATIVES FOR USE AS ANTIVIRAL AND ANTITUMOUR AGENTS RDP Pharma AG (CH) 2024-02-21 EP claimed
CN-114831991-B Application of GSK2334470 in preparing antifungal medicament and synergist thereof 陕西科技大学 2024-02-06 CN claimed
WO-2024011307-A1 PYRAZOLO[3,4-D]PYRIMIDIN-6-YL-SULFONAMIDE DERIVATIVES FOR THE INHIBITION OF SGK-1 AND TREATMENT OF CANCER THRYV THERAPEUTICS INC. (CA) 2024-01-18 WO claimed
CN-117377474-A Isoquinoline derivatives as antiviral and antitumor agents RDP制药股份公司 2024-01-09 CN claimed
US-11696924-B2 Combination therapy using PDK1 and PI3K inhibitors MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2023-07-11 US claimed
WO-2023044386-A1 COMPOSITION FOR TREATING, PREVENTING, OR AMELIORATING MELANOMA AND METHOD THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2023-03-23 WO claimed
WO-2022219157-A1 ISOQUINOLINE DERIVATIVES FOR USE AS ANTIVIRAL AND ANTITUMOUR AGENTS VALDOSPAN GMBH (AT) 2022-10-20 WO claimed
WO-2022192372-A1 METHODS AND COMPOSITIONS FOR TUSC2 COMBINATION THERAPY WITH PDK1 INHIBITION BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 2022-09-15 WO claimed
CN-114831991-A Application of GSK2334470 in preparation of antifungal drugs and synergist thereof 陕西科技大学 2022-08-02 CN claimed
US-20220152116-A1 MULTI-STAGE PERSONALIZED LONGEVITY THERAPEUTICS INSILICO MEDICINE IP LIMITED (HK) 2022-05-19 US claimed
US-11260078-B2 Method of treating senescence with multi-stage longevity therapeutics INSILICO MEDICINE IP LIMITED (HK) 2022-03-01 US claimed

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-20220152116-A1 MULTI-STAGE PERSONALIZED LONGEVITY THERAPEUTICS SENP6, SENP1, GLA PDPK1 2761/4885AURKB 1798/4885AURKA 2989/4885
US-11260078-B2 Method of treating senescence with multi-stage longevity therapeutics SENP6, GLA, SENP1 PDPK1 2804/4885AURKB 1906/4885AURKA 3129/4885
US-20240382484-A1 COMPOSITION FOR TREATING, PREVENTING, OR AMELIORATING MELANOMA AND METHOD THEREOF PDPK1, PLK3, PLK2 PDPK1 1/4885AURKB 306/4885AURKA 162/4885

“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.