SCHEMBL8099685

SCHEMBL8099685

COc1ccc(CCNC(N)=O)cc1OC

nearest known ligand 0.77

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.73
CA2 P00918 2/20 0.73
CA9 Q16790 2/20 0.73
CA12 O43570 1/20 0.73
KMT2A Q03164 4/20 0.72
MAPT P10636 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.68
ALDH1A1 P00352 4/20 0.66
MEN1 O00255 3/20 0.64
GAA P10253 1/20 0.64
POLB P06746 2/20 0.63
ATM Q13315 1/20 0.63
CA7 P43166 1/20 0.62
CA14 Q9ULX7 1/20 0.62
LMNA P02545 1/20 0.62

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
SCHEMBL10841849 0.91 MTNR1A (0.62) CA1CA2CA9CA12KMT2A
SCHEMBL27439284 0.90 CA12 (0.60) CA1CA2CA9CA12KMT2A
SCHEMBL7358841 0.88 CA12 (0.69) CA1CA2CA9CA12KMT2A
SCHEMBL2224069 0.87 CA12 (0.73) CA1CA2CA9CA12KMT2A
SCHEMBL901614 0.87 CA12 (0.73) CA1CA2CA9CA12KMT2A
SCHEMBL7265002 0.87 CA12 (0.73) CA1CA2CA9CA12KMT2A
SCHEMBL10359474 0.87 CA12 (0.73) CA1CA2CA9CA12KMT2A
SCHEMBL25773443 0.87 MTNR1A (0.69) CA1CA2CA9CA12KMT2A
SCHEMBL12635586 0.87 CA12 (0.57) CA1CA2CA9CA12KMT2A
Water SCHEMBL11279885 0.86 CA12 (0.71) CA1CA2CA9CA12KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1379668-A 3(5)-ureido-pyrazole derivatives, process for their preparation and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2002-11-13 CN claimed
WO-2026003867-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF ENSIFENTRINE AND ITS PURIFICATION THEREOF NEULAND LABORATORIES LIMITED (IN) 2026-01-02 WO disclosed
EP-4609864-A1 PHARMACEUTICAL COMPOSITION CONTAINING ISOQUINOLINONE COMPOUND, AND PREPARATION METHOD THEREFOR Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2025-09-03 EP disclosed
EP-4610257-A1 CRYSTAL FORM OF ISOQUINOLINONE COMPOUND AND PREPARATION METHOD THEREFOR Jiangsu Hengrui Pharmaceuticals Co., Ltd. (CN) 2025-09-03 EP disclosed
CN-119923263-A Pharmaceutical composition containing isoquinolinones and preparation method thereof 江苏恒瑞医药股份有限公司 2025-05-02 CN disclosed
US-20240217974-A1 ISOQUINOLONE COMPOUND AND USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2024-07-04 US disclosed
US-20240217974-A1 ISOQUINOLONE COMPOUND AND USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2024-07-04 US disclosed
US-20240217974-A1 ISOQUINOLONE COMPOUND AND USE THEREOF JIANGSU HENGRUI PHARMACEUTICALS CO., LTD. (CN) 2024-07-04 US disclosed
WO-2024088402-A1 CRYSTAL FORM OF ISOQUINOLINONE COMPOUND AND PREPARATION METHOD THEREFOR 江苏恒瑞医药股份有限公司 2024-05-02 WO disclosed
WO-2024088364-A1 PHARMACEUTICAL COMPOSITION CONTAINING ISOQUINOLINONE COMPOUND, AND PREPARATION METHOD THEREFOR 江苏恒瑞医药股份有限公司 2024-05-02 WO disclosed
CN-116917287-A Isoquinolinones and use thereof 苏州盛迪亚生物医药有限公司 2023-10-20 CN disclosed
WO-2023109802-A1 TRICYCLIC FUSED HETEROCYCLIC PDE3/4 DUAL INHIBITOR AND USE THEREOF 海思科医药集团股份有限公司 2023-06-22 WO disclosed
WO-2022228544-A1 ISOQUINOLONE COMPOUND AND USE THEREOF 苏州盛迪亚生物医药有限公司 2022-11-03 WO disclosed
US-6063789-A Aminoisoquinolines and aminotheinopyridine derivatives and their use as anti-inflammatory agents ASTRA PHARMACEUTICALS, LTD. (GB) 2000-05-16 US disclosed
EP-0973773-A1 PYRIMIDO-ISOQUINOLINE COMPOUNDS WITH ANTICONVULSIVE ACTION SMITHKLINE BEECHAM PLC (GB) 2000-01-26 EP disclosed
CN-1221407-A Aminoisoquinolines and aminothienopyridine derivatives and their use as anti-inflammatory agents ASTRA PHARMA PROD (GB) 1999-06-30 CN disclosed
EP-0892784-A1 AMINOISOQUINOLINES AND AMINOTHIENOPYRIDINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS Astra Pharmaceuticals Limited (GB) 1999-01-27 EP disclosed
WO-1998045293-A1 PYRIMIDO-ISOQUINOLINE COMPOUNDS WITH ANTICONVULSIVE ACTION SMITHKLINE BEECHAM PLC (GB) 1998-10-15 WO disclosed
WO-1997038977-A1 AMINOISOQUINOLINES AND AMINOTHIENOPYRIDINE DERIVATIVES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS ASTRA PHARMACEUTICALS LTD. (GB) 1997-10-23 WO disclosed
US-4581172-A Substituted pyrimido[6,1-a]isoquinolin-4-ones,pyrimido[6,1-a]benzozepin-4-ones and pyrimido[6,1-a]benzodiazepin-4-ones useful for prevention of thromboses and treating hypertension HOFFMANN-LA ROCHE INC. (US) 1986-04-08 US 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-20240217974-A1 ISOQUINOLONE COMPOUND AND USE THEREOF CYP4A11, CYP11B2, NQO1 CA1 3724/4885CA2 2727/4885CA9 4336/4885

“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.