SCHEMBL669908

SCHEMBL669908

COc1cc2c(cc1OC)C(=O)OC(=O)C2

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 2/20 0.59
MAPT P10636 3/20 0.47
ACHE P22303 4/20 0.45
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
THRB P10828 1/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
LMNA P02545 2/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41
CA4 P22748 1/20 0.41
CA6 P23280 1/20 0.41
HTT P42858 2/20 0.40
ABCB1 P08183 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
HPGD P15428 1/20 0.40
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL31410961 1.00 CYP3A4 (0.59) CYP3A4MAPTACHEKDM4EALDH1A1
SCHEMBL22689188 0.88 CYP3A4 (0.46) CYP3A4MAPTACHEKDM4EALDH1A1
SCHEMBL16134866 0.83 CYP3A4 (0.62) CYP3A4MAPTACHEKDM4EALDH1A1
SCHEMBL21426605 0.80 AKR1B1 (0.39) MAOAMAOB
SCHEMBL1399862 0.79 METAP1 (0.55) CYP3A4MAPTACHEKDM4EALDH1A1
SCHEMBL21426609 0.78 AKR1B1 (0.38) MAOAMAOB
SCHEMBL2928543 0.76 CYP3A4 (0.53) CYP3A4ACHEMEN1KMT2ACA1
SCHEMBL29557279 0.76 CYP3A4 (0.53) CYP3A4ACHEMEN1KMT2ACA1
SCHEMBL2334456 0.76 METAP1 (0.57) CYP3A4MAPTACHEKDM4EALDH1A1
SCHEMBL16156009 0.75 CYP3A4 (0.56) CYP3A4MAPTACHEKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250074917-A1 Preparation and Uses of 7-Azaindenoisoquinolines PURDUE RESEARCH FOUNDATION 2025-03-06 US disclosed
US-20240287089-A1 Preparation and Uses of 7-Azaindenoisoquinolines PURDUE RESEARCH FOUNDATION (US) 2024-08-29 US disclosed
WO-2023215238-A1 PREPARATION AND USES OF 7-AZAINDENOISOQUINOLINES PURDUE RESEARCH FOUNDATION (US) 2023-11-09 WO disclosed
WO-2023215238-A1 PREPARATION AND USES OF 7-AZAINDENOISOQUINOLINES PURDUE RESEARCH FOUNDATION (US) 2023-11-09 WO disclosed
US-9073920-B2 Substituted dibenzonaphthyridines, pharmaceutical uses thereof and processes therfor PURDUE RESEARCH FOUNDATION (US) 2015-07-07 US disclosed
US-9073920-B2 Substituted dibenzonaphthyridines, pharmaceutical uses thereof and processes therfor PURDUE RESEARCH FOUNDATION (US) 2015-07-07 US disclosed
US-9034870-B2 Azaindenoisoquinoline topoisomerase I inhibitors PURDUE RESEARCH FOUNDATION (US) 2015-05-19 US disclosed
US-9034870-B2 Azaindenoisoquinoline topoisomerase I inhibitors PURDUE RESEARCH FOUNDATION (US) 2015-05-19 US disclosed
US-20140187547-A1 AZAINDENOISOQUINOLINE TOPOISOMERASE I INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2014-07-03 US disclosed
US-20140187547-A1 AZAINDENOISOQUINOLINE TOPOISOMERASE I INHIBITORS PURDUE RESEARCH FOUNDATION (US) 2014-07-03 US disclosed
US-20080214576-A1 Topoisomerase Inhibitors and Prodrugs THRESHOLD PHARMACEUTICALS, INC. (US) 2008-09-04 US disclosed
US-7250410-B2 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof VIA PHARMACEUTICALS, INC. (US) 2007-07-31 US disclosed
US-20070015751-A1 Nitro and amino substituted heterocycles as topoisomerase I targeting agents RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY 2007-01-18 US disclosed
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof BAY CITY CAPITAL LLC 2004-08-05 US disclosed
EP-1392663-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2004-03-03 EP disclosed
US-6509344-B1 A method for treating a patient having cancer, said method comprising the step of administering to the patient an effective amount of a compound according to claim 1, whereupon said patient is treated for cancer, and wherein the cancer is THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES 2003-01-21 US disclosed
WO-2002098865-A2 CYCLIC NUCLEOTIDE PHOSPHODIESTERASE INHIBITORS, PREPARATION AND USES THEREOF NEURO3D (FR) 2002-12-12 WO disclosed
EP-1123099-A4 NOVEL INDENOISOQUINOLINES AS ANTINEOPLASTIC AGENTS PURDUE RESEARCH FOUNDATION (US) 2002-08-21 EP disclosed
EP-1123099-A1 NOVEL INDENOISOQUINOLINES AS ANTINEOPLASTIC AGENTS PURDUE RESEARCH FOUNDATION (US) 2001-08-16 EP disclosed
WO-2000021537-A1 NOVEL INDENOISOQUINOLINES AS ANTINEOPLASTIC AGENTS PURDUE RESEARCH FOUNDATION (US) 2000-04-20 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 (6 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-20070015751-A1 Nitro and amino substituted heterocycles as topoisomerase I targeting agents TOP1, TOP2A, TOP2B CYP3A4 529/4885MAPT 4497/4885ACHE 2045/4885
US-20250074917-A1 Preparation and Uses of 7-Azaindenoisoquinolines MYC, MYCBP, DNMT1 CYP3A4 3176/4885MAPT 2450/4885ACHE 4790/4885
US-20140187547-A1 AZAINDENOISOQUINOLINE TOPOISOMERASE I INHIBITORS TOP2A, TOP1, TOP2B CYP3A4 558/4885MAPT 3992/4885ACHE 1609/4885
US-20080214576-A1 Topoisomerase Inhibitors and Prodrugs TOP2A, TOP1, TOP2B CYP3A4 1499/4885MAPT 2510/4885ACHE 2261/4885
US-20040152888-A1 Cyclic nucleotide phosphodiesterase inhibitors, preparation and uses thereof PDE7A, PDE3B, PDE3A CYP3A4 264/4885MAPT 4388/4885ACHE 163/4885
US-20240287089-A1 Preparation and Uses of 7-Azaindenoisoquinolines MYC, MYCBP, DNMT1 CYP3A4 3176/4885MAPT 2450/4885ACHE 4790/4885

“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.