Idarubicin

Idarubicin

SCHEMBL10061859

CC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@@H](N)[C@H](O)C(C)O2)C1)C(=O)c1ccccc1C3=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

TOP2A

The experimentally established mechanism targets of Idarubicin. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A known ✓ P11388 4/20 1.00
MEN1 O00255 9/20 1.00
THRB P10828 9/20 1.00
KMT2A Q03164 9/20 1.00
BLM P54132 8/20 1.00
RECQL P46063 7/20 1.00
MAPT P10636 6/20 1.00
BRCA1 P38398 6/20 1.00
SMN1; SMN2 Q16637 6/20 1.00
HIF1A Q16665 6/20 1.00
MAPK1 P28482 5/20 1.00
HTT P42858 5/20 1.00
S100A4 P26447 5/20 1.00
CYP3A4 P08684 4/20 1.00
USP2 O75604 4/20 1.00
CYP1A2 P05177 4/20 1.00
CHRM1 P11229 4/20 1.00
STAT6 P42226 4/20 1.00
APEX1 P27695 3/20 1.00
NPC1 O15118 3/20 1.00

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
Idarubicin SCHEMBL13488561 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL16609956 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL12257447 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL15159345 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL13575798 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL18738468 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL3750 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL16606206 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL7029978 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL
Idarubicin SCHEMBL20541733 1.00 MEN1 (1.00) MEN1THRBKMT2ABLMRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10034851-B2 Metal-salen complex compound, local anesthetic and antineoplastic drug IHI CORPORATION (JP) 2018-07-31 US disclosed
US-9505732-B2 Auto magnetic metal salen complex compound IHI CORPORATION (JP) 2016-11-29 US disclosed
US-20160263074-A1 METAL-SALEN COMPLEX COMPOUND, LOCAL ANESTHETIC AND ANTINEOPLASTIC DRUG ISHIKAWA YOSHIHIRO (JP) 2016-09-15 US disclosed
US-20160263074-A1 METAL-SALEN COMPLEX COMPOUND, LOCAL ANESTHETIC AND ANTINEOPLASTIC DRUG ISHIKAWA YOSHIHIRO (JP) 2016-09-15 US disclosed
US-20140206635-A1 METAL-SALEN COMPLEX COMPOUND, LOCAL ANESTHETIC AND ANTINEOPLASTIC DRUG IHI CORPORATION (JP) 2014-07-24 US disclosed
US-20140206635-A1 METAL-SALEN COMPLEX COMPOUND, LOCAL ANESTHETIC AND ANTINEOPLASTIC DRUG IHI CORPORATION (JP) 2014-07-24 US disclosed
US-20140046021-A1 SELF-MAGNETIC METAL-SALEN COMPLEX COMPOUND IHI CORPORATION (JP) 2014-02-13 US disclosed
US-20140046021-A1 SELF-MAGNETIC METAL-SALEN COMPLEX COMPOUND IHI CORPORATION (JP) 2014-02-13 US disclosed
US-20120029167-A1 AUTO MAGNETIC METAL SALEN COMPLEX COMPOUND YOSHIHIRO ISHIKAWA (JP) 2012-02-02 US disclosed
US-20070004653-A1 Stable lyophilized anthracycline glycosides SICOR, INC. 2007-01-04 US disclosed
US-20070004653-A1 Stable lyophilized anthracycline glycosides SICOR, INC. 2007-01-04 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 (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-20120029167-A1 AUTO MAGNETIC METAL SALEN COMPLEX COMPOUND SDHB, SDHA, SLC40A1 TOP2A 914/4885MEN1 9/4885THRB 2995/4885
US-20140206635-A1 METAL-SALEN COMPLEX COMPOUND, LOCAL ANESTHETIC AND ANTINEOPLASTIC DRUG NCLN, KCNN2, NCSTN TOP2A 490/4885MEN1 435/4885THRB 4697/4885
US-10034851-B2 Metal-salen complex compound, local anesthetic and antineoplastic drug NCLN, KCNN2, NCSTN TOP2A 490/4885MEN1 435/4885THRB 4697/4885
US-20140046021-A1 SELF-MAGNETIC METAL-SALEN COMPLEX COMPOUND SSBP1, KCNN1, IMMT TOP2A 698/4885MEN1 74/4885THRB 3508/4885
US-20160263074-A1 METAL-SALEN COMPLEX COMPOUND, LOCAL ANESTHETIC AND ANTINEOPLASTIC DRUG NCLN, KCNN2, NCSTN TOP2A 490/4885MEN1 435/4885THRB 4697/4885
US-20070004653-A1 Stable lyophilized anthracycline glycosides TREH, CD38, GANAB TOP2A 7/4885MEN1 1864/4885THRB 4793/4885

“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.