Valrubicin

Valrubicin

SCHEMBL29418969

CCCCC(=O)OCC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](O[C@H]2C[C@H](NC(=O)C(F)(F)F)[C@H](O)[C@H](C)O2)C1)C(=O)c1c(OC)cccc1C3=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 Valrubicin. 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 0.62
MEN1 O00255 8/20 1.00
THRB P10828 8/20 1.00
KMT2A Q03164 8/20 1.00
HTT P42858 3/20 1.00
LMNA P02545 2/20 1.00
ABCC4 O15439 2/20 1.00
ABCC2 Q92887 2/20 1.00
ABCC3 O15438 1/20 1.00
ABCB11 O95342 1/20 1.00
CHN2 P52757 1/20 0.65
PRKCD Q05655 1/20 0.65
RECQL P46063 6/20 0.62
BLM P54132 6/20 0.62
TDP1 Q9NUW8 5/20 0.62
HIF1A Q16665 5/20 0.62
SMN1; SMN2 Q16637 5/20 0.62
BRCA1 P38398 5/20 0.62
MAPT P10636 4/20 0.62
MAPK1 P28482 4/20 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
Valrubicin SCHEMBL12556870 1.00 MEN1 (1.00) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL12825 1.00 MEN1 (1.00) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL15372178 1.00 MEN1 (1.00) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL20541443 1.00 MEN1 (1.00) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL12824 1.00 MEN1 (1.00) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL4053249 1.00 MEN1 (1.00) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL1652790 1.00 MEN1 (1.00) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL22463650 0.99 MEN1 (0.99) MEN1THRBKMT2AHTTLMNA
Valrubicin SCHEMBL28183048 0.98 MEN1 (0.97) MEN1THRBKMT2AHTTLMNA
SCHEMBL13394009 0.96 MEN1 (0.93) MEN1THRBKMT2AHTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-122075497-A Use of NLRP3 agonist for tumor treatment 2026-05-26 CN claimed
EP-3790536-B1 NANOCONTAINERS FOR TRANSPORTING NONPOLAR, LIPOPHILIC SUBSTANCES SUCH AS ANTIBIOTICS KARLSRUHER INST TECHNOLOGIE (DE) 2026-04-22 EP claimed
EP-3746081-B1 PDE1 INHIBITORS FOR USE TO TREAT CARDIAC FAILURE AND CARDIOTOXICITY INTRA CELLULAR THERAPIES INC (US) 2026-04-01 EP claimed
EP-3710001-B1 COMPOUNDS AND METHODS FOR REGULATING, LIMITING, OR INHIBITING AVIL EXPRESSION UNIV VIRGINIA PATENT FOUNDATION (US) 2025-06-18 EP claimed
CN-120004785-A Compounds and compositions for the treatment of diseases associated with STING activity 诺华制药股份有限公司 2025-05-16 CN claimed
CN-119970803-A Application of bacteria of genus Agrimonia in preparation of antitumor drugs 深圳未知君生物科技有限公司 2025-05-13 CN claimed
EP-4178588-B1 ANTI-CANCER ACTIVITY OF PERBORATE SALTS ALIYA PHARMACEUTICALS INC (CA) 2025-05-07 EP claimed
EP-4547872-A1 BIOMARKERS IN COLORECTAL CANCER City of Hope (US) 2025-05-07 EP claimed
EP-3986438-B1 P53 ACTIVATOR PEPTIDOMIMETIC MACROCYCLES MERCK SHARP & DOHME LLC (US) 2025-04-16 EP claimed
CN-119735540-A Compounds and compositions for the treatment of diseases associated with STING activity 诺华制药股份有限公司 2025-04-01 CN claimed
EP-3274044-B1 ULTRASONIC URINARY BLADDER DRUG DELIVERY VENSICA MEDICAL LTD (IL) 2023-03-01 EP claimed
EP-3674302-B1 1H-PYRROLO[2,3-C]PYRIDIN-7(6H)-ONES AND PYRAZOLO[3,4-C]PYRIDIN-7(6H)-ONES AS INHIBITORS OF BET PROTEINS INCYTE HOLDINGS CORP (US) 2023-03-01 EP claimed
EP-3851107-B1 HETEROARYL-KETONE FUSED AZADECALIN GLUCOCORTICOID RECEPTOR MODULATORS CORCEPT THERAPEUTICS INC (US) 2022-10-19 EP claimed
EP-3404118-B1 METHODS FOR PREDICTING DRUG RESPONSIVENESS IN CANCER PATIENTS Allarity Therapeutics Europe ApS (DK) 2022-07-27 EP claimed
EP-3426657-B1 2 AMINO N [7 METHOXY 2, 3-DIHYDROIMIDAZO-[1, 2-C]QUINAZOLIN-5-YL]PYRIMIDINE 5 CARBOXAMIDES Bayer Pharma AG (DE) 2022-07-13 EP claimed
EP-1931320-B1 MICROPARTICLES WITH MODIFIED RELEASE OF AT LEAST ONE ACTIVE PRINCIPLE AND ORAL DOSAGE FORM COMPRISING THE SAME FLAMEL IRELAND LTD (IE) 2022-06-15 EP claimed
EP-3288558-B1 COMBINATIONS OF INHIBITORS OF IRAK4 WITH INHIBITORS OF BTK Bayer Pharma AG (DE) 2022-05-11 EP claimed
EP-3324954-B1 AMINONAPTHOQUINONE COMPOUNDS AND PHARMACEUTICAL COMPOSITION FOR BLOCKING UBIQUITINATION-PROTEASOME SYSTEM IN DISEASES CALGENT BIOTECHNOLOGY CO LTD (TW) 2022-03-09 EP claimed
EP-3354650-B1 COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE VERTEX PHARMA (US) 2022-02-16 EP claimed
EP-3193917-B9 VACCINE COMPOSITIONS COMPRISING TRYPTOPHAN 2,3-DIOXYGENASE OR FRAGMENTS THEREOF IO BIOTECH APS (DK) 2022-02-16 EP claimed