SCHEMBL3826448

SCHEMBL3826448

CCOC/C=C/c1ccc(-c2nc(-c3ccc(NC(C)C)cc3)c(-c3ccc(NC(C)C)cc3)[nH]2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 1.00
▸ PTPN1 P18031 1/20 0.40
▸ MAPT P10636 3/20 0.39
▸ NOX1 Q9Y5S8 2/20 0.37
▸ MAPK13 O15264 6/20 0.37
▸ MAPK12 P53778 6/20 0.37
▸ MAPK11 Q15759 6/20 0.37
▸ MAPK14 Q16539 6/20 0.37
▸ GCGR P47871 3/20 0.36
▸ ALOX5 P09917 2/20 0.36
▸ TP53 P04637 2/20 0.35
▸ RAF1 P04049 2/20 0.35
▸ BRAF P15056 1/20 0.35
▸ SELP P16109 2/20 0.34
▸ SELE P16581 1/20 0.34
▸ PRKD3 O94806 1/20 0.34
▸ MAP4K4 O95819 1/20 0.34
▸ FRK P42685 1/20 0.34
▸ MAPK9 P45984 1/20 0.34
▸ CSNK1A1 P48729 1/20 0.34

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
SCHEMBL719050 1.00 ABCB1 (1.00) ABCB1PTPN1MAPTNOX1MAPK13
SCHEMBL13679699 0.96 ABCB1 (0.92) ABCB1PTPN1MAPTNOX1MAPK13
SCHEMBL3830858 0.96 ABCB1 (0.92) ABCB1PTPN1MAPTNOX1MAPK13
SCHEMBL3829640 0.95 ABCB1 (0.91) ABCB1PTPN1MAPTNOX1MAPK13
SCHEMBL13679717 0.95 ABCB1 (0.91) ABCB1PTPN1MAPTNOX1MAPK13
SCHEMBL13780563 0.95 ABCB1 (0.91) ABCB1PTPN1MAPTNOX1MAPK13
SCHEMBL13679665 0.95 ABCB1 (0.91) ABCB1MAPK13MAPK12MAPK11MAPK14
SCHEMBL3824437 0.95 ABCB1 (0.91) ABCB1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5468480 0.94 ABCB1 (0.89) ABCB1PTPN1MAPTNOX1MAPK11
SCHEMBL30357745 0.93 ABCB1 (0.87) ABCB1PTPN1MAPTNOX1MAPK13

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117771378-A Pharmaceutical composition for improving bioavailability of KRAS inhibitor and application thereof 贝达药业股份有限公司 2024-03-29 — — CN claimed
CN-117462688-A Composition comprising KRAS G12D inhibitor 江苏恒瑞医药股份有限公司 2024-01-30 — — CN claimed
US-11744842-B2 Methods for the effective treatment of metastatic cancer GENERAL ONCOLOGY, INC. (US) 2023-09-05 — — US claimed
US-20220362236-A1 NOVEL METHODS OF TREATING A NEURODEGENERATIVE DISEASE IN A MAMMAL IN NEED THEREOF UNIV JEFFERSON (US) 2022-11-17 — — US claimed
US-11369596-B2 Methods of treating a neurodegenerative disease in a mammal in need thereof THOMAS JEFFERSON UNIVERSITY (US) 2022-06-28 — — US claimed
EP-3875078-A1 COMPOUNDS FOR THE TREATMENT OF COVID-19 Dompe' Farmaceutici S.P.A. (IT) 2021-09-08 — — EP claimed
US-20190192503-A1 NOVEL METHODS OF TREATING A NEURODEGENERATIVE DISEASE IN A MAMMAL IN NEED THEREOF THOMAS JEFFERSON UNIVERSITY (US) 2019-06-27 — — US claimed
US-10258615-B2 Methods of treating a neurodegenerative disease in a mammal in need thereof THOMAS JEFFERSON UNIVERSITY (US) 2019-04-16 — — US claimed
EP-4747229-A1 ANTI-TUMOR COMPOUNDS AND METHODS OF USE THEREOF AND SYNTHESIS THEREOF Atossa Therapeutics, Inc. (US) 2026-05-27 — — EP disclosed
WO-2026104851-A1 PHARMACEUTICAL COMPOSITIONS Apollo AP10 Limited (GB) 2026-05-21 — — WO disclosed
WO-2026101937-A1 COMPOSITIONS COMPRISING (Z)-ENDOXIFEN AND A CDK4/6 INHIBITOR AND METHODS OF USE THEREOF ATOSSA THERAPEUTICS, INC. (US) 2026-05-15 — — WO disclosed
US-20260132164-A1 PNU ANTHRACYCLINE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME LLC (US) 2026-05-14 — — US disclosed
WO-2026090615-A1 POLYOXAZOLINE MICELLAR PHARMACEUTICAL COMPOSITIONS THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL OFFICE OF TECHNOLOGY COMMERCIALIZATION (US) 2026-04-30 — — WO disclosed
EP-4076459-B1 PRMT5 INHIBITORS MERCK SHARP & DOHME LLC (US) 2026-04-29 — — EP disclosed
US-20070203215-A1 Methods & Compositions For Enhancing Pharmaceutical Treatments TAIJI BIOMEDICAL, INC. (US) 2007-08-30 — — US disclosed
US-20070203215-A1 Methods & Compositions For Enhancing Pharmaceutical Treatments TAIJI BIOMEDICAL, INC. (US) 2007-08-30 — — US disclosed
EP-0999835-A4 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORP (US) 2004-08-25 — — EP disclosed
EP-0999835-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS Ontogen Corporation (US) 2000-05-17 — — EP disclosed
WO-1999002155-A1 IMIDAZOLE DERIVATIVES AS MDR MODULATORS ONTOGEN CORPORATION (US) 1999-01-21 — — WO disclosed
US-5840721-A INCREASE SENSITIVITY OF MULTIDRUG RESISTANT TUMOR CELLS TO ANTICANCER AGENTS ONTOGEN CORPORATION (US) 1998-11-24 — — 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 (2 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-20070203215-A1 Methods & Compositions For Enhancing Pharmaceutical Treatments TUBB3, TUBB1, TUBB2A ABCB1 21/4885PTPN1 3797/4885MAPT 26/4885
US-20260132164-A1 PNU ANTHRACYCLINE DERIVATIVES AND METHODS OF USE THEREOF TOP1, NCL, NOLC1 ABCB1 31/4885PTPN1 476/4885MAPT 4774/4885

“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.

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