Idarubicin

Idarubicin

SCHEMBL454665

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

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 5/20 0.98
ECE1 P42892 1/20 1.00
MUS81 Q96NY9 1/20 1.00
MEN1 O00255 10/20 0.98
THRB P10828 10/20 0.98
KMT2A Q03164 10/20 0.98
BLM P54132 9/20 0.98
RECQL P46063 8/20 0.98
MAPT P10636 7/20 0.98
BRCA1 P38398 7/20 0.98
SMN1; SMN2 Q16637 7/20 0.98
HIF1A Q16665 7/20 0.98
MAPK1 P28482 6/20 0.98
HTT P42858 5/20 0.98
USP2 O75604 5/20 0.98
CYP3A4 P08684 5/20 0.98
S100A4 P26447 5/20 0.98
STAT6 P42226 5/20 0.98
NPC1 O15118 4/20 0.98
RAB9A P51151 4/20 0.98

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 SCHEMBL29367370 1.00 ECE1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL5323218 1.00 ECE1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL4838 1.00 ECE1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL20838939 0.99 ECE1 (0.98) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL16606206 0.99 MEN1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL7029978 0.99 MEN1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL16609956 0.99 MEN1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL20541733 0.99 MEN1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL15159345 0.99 MEN1 (1.00) ECE1MUS81MEN1THRBKMT2A
Idarubicin SCHEMBL12257447 0.99 MEN1 (1.00) ECE1MUS81MEN1THRBKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11571459-B2 Methods for treating cancer using PS-targeting antibodies with immuno-oncology agents ONCXERNA THERAPEUTICS, INC. (US) 2023-02-07 US disclosed
US-20180289771-A1 METHODS FOR TREATING CANCER USING PS-TARGETING ANTIBODIES WITH IMMUNO-ONCOLOGY AGENTS ONCXERNA THERAPEUTICS, INC. 2018-10-11 US disclosed
US-9421256-B2 Anti-VEGF antibody compositions and methods AFFITECH RESEARCH AS (NO) 2016-08-23 US disclosed
US-20130149238-A1 Anti-VEGF Antibody Compositions and Methods PEREGRINE PHARMACEUTICALS, INC. (US) 2013-06-13 US disclosed
US-8394943-B2 Anti-VEGF antibody compositions and methods AFFITECH RESEARCH AS (NO) 2013-03-12 US disclosed
US-20120064001-A1 Anti-VEGF Antibody Compositions and Methods AFFITECH RESEARCH AS (NO) 2012-03-15 US disclosed
US-20090175791-A1 Anti-VEGF Antibody Compositions and Methods PEREGRINE PHARMACEUTICALS, INC. (US) 2009-07-09 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-20180289771-A1 METHODS FOR TREATING CANCER USING PS-TARGETING ANTIBODIES WITH IMMUNO-ONCOLOGY AGENTS CD47, TP53, CD274 TOP2A 1072/4885ECE1 2332/4885MUS81 1160/4885

“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.