Chaetocin

Chaetocin

SCHEMBL14021817

CN1C(=O)[C@@]23CC4([C@]56C[C@@]78SS[C@@](CO)(C(=O)N7[C@H]5Nc5ccccc56)N(C)C8=O)c5ccccc5N[C@@H]4N2C(=O)[C@]1(CO)SS3

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EHMT2 Q96KQ7 14/20 1.00
SUV39H1 O43463 4/20 1.00
HIF1A Q16665 4/20 1.00
EP300 Q09472 4/20 1.00
NSD2 O96028 2/20 1.00
TXNRD1 Q16881 1/20 1.00
NSD1 Q96L73 1/20 1.00
NSD3 Q9BZ95 1/20 1.00
PKM P14618 1/20 0.45
FNTA P49354 1/20 0.45
FNTB P49356 1/20 0.45
PGGT1B P53609 1/20 0.45
RNF31 Q96EP0 1/20 0.45
RBCK1 Q9BYM8 1/20 0.45
SHARPIN Q9H0F6 1/20 0.45
KMT2A Q03164 1/20 0.43
CREBBP Q92793 1/20 0.40
HKDC1 Q2TB90 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
Chaetocin SCHEMBL29711289 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL29378100 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL29362026 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL17610180 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL13662584 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL19382420 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL13662582 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL22065398 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL20796284 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2
Chaetocin SCHEMBL15791273 1.00 EHMT2 (1.00) EHMT2SUV39H1HIF1AEP300NSD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255099-A1 Use of Diketodithiopiperazine Antibiotics for the Preparation of Antiangiogenic Pharmaceutical Compositions CELL THERAPEUTICS, INC. (US) 2008-10-16 US disclosed
US-20080255099-A1 Use of Diketodithiopiperazine Antibiotics for the Preparation of Antiangiogenic Pharmaceutical Compositions CELL THERAPEUTICS, INC. (US) 2008-10-16 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-20080255099-A1 Use of Diketodithiopiperazine Antibiotics for the Preparation of Antiangiogenic Pharmaceutical Compositions KLF5, DHPS, HDGF EHMT2 2893/4885SUV39H1 1159/4885HIF1A 386/4885

“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.