Cerulenin

Cerulenin

SCHEMBL4450603

CC=CCC=CCCC(=O)C1OC1C(N)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 1.00
F13A1 P00488 4/20 1.00
MAPT P10636 3/20 1.00
PTGS1 P23219 2/20 1.00
THRB P10828 1/20 1.00
FASN P49327 1/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
CNR1 P21554 6/20 0.37
CYP19A1 P11511 2/20 0.36
RXRA P19793 2/20 0.36
PPARG P37231 2/20 0.36
OXER1 Q8TDS5 2/20 0.36
FFAR1 O14842 1/20 0.36
KDM4E B2RXH2 2/20 0.36
SOAT1 P35610 1/20 0.36
CNR2 P34972 4/20 0.33
TGM2 P21980 3/20 0.31
F7 P08709 1/20 0.31
ADORA3 P0DMS8 1/20 0.31
F3 P13726 1/20 0.31

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
Cerulenin SCHEMBL20528755 1.00 ALDH1A1 (1.00) ALDH1A1F13A1MAPTPTGS1THRB
Cerulenin SCHEMBL3183350 1.00 ALDH1A1 (1.00) ALDH1A1F13A1MAPTPTGS1THRB
Cerulenin SCHEMBL8678332 1.00 ALDH1A1 (1.00) ALDH1A1F13A1MAPTPTGS1THRB
Cerulenin SCHEMBL41207 1.00 ALDH1A1 (1.00) ALDH1A1F13A1MAPTPTGS1THRB
Cerulenin SCHEMBL28576416 1.00 ALDH1A1 (1.00) ALDH1A1F13A1MAPTPTGS1THRB
Cerulenin SCHEMBL10387308 1.00 ALDH1A1 (1.00) ALDH1A1F13A1MAPTPTGS1THRB
Cerulenin SCHEMBL8716153 1.00 ALDH1A1 (1.00) ALDH1A1F13A1MAPTPTGS1THRB
SCHEMBL12902003 0.85 ALDH1A1 (0.74) ALDH1A1F13A1MAPTPTGS1THRB
SCHEMBL17874340 0.85 ALDH1A1 (0.74) ALDH1A1F13A1MAPTPTGS1THRB
SCHEMBL9453468 0.81 ALDH1A1 (0.68) ALDH1A1F13A1MAPTPTGS1THRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325877-A1 Combination Product of Receptor Tyrosine Kinase Inhibitor and Fatty Acid Synthase Inhibitor for Treating Cancer WYETH (US) 2009-12-31 US disclosed
WO-2009151910-A2 COMBINATION PRODUCT OF RECEPTOR TYROSINE KINASE INHIBITOR AND FATTY ACID SYNTHASE INHIBITOR FOR TREATING CANCER WYETH (US) 2009-12-17 WO disclosed
EP-1565180-A4 A METHOD FOR INHIBITING CANCER DEVELOPMENT BY FATTY ACID SYNTHASE INHIBITORS FASGEN LLC (US) 2008-02-27 EP disclosed
US-20070142456-A1 Method for inhibiting cancer development by fatty acid synthase inhibitors FASGEN, LLC (US) 2007-06-21 US disclosed
EP-1565180-A2 A METHOD FOR INHIBITING CANCER DEVELOPMENT BY FATTY ACID SYNTHASE INHIBITORS Fasgen, LLC (US) 2005-08-24 EP disclosed
WO-2004041189-A2 A METHOD FOR INHIBITING CANCER DEVELOPMENT BY FATTY ACID SYNTHASE INHIBITORS FASGEN LLC (US) 2004-05-21 WO disclosed
EP-0651636-B1 CHEMOTHERAPY FOR CANCER UNIV JOHNS HOPKINS (US) 2002-10-02 EP disclosed
EP-0738107-B1 INHIBITORS OF FATTY ACID SYNTHESIS AS ANTIMICROBIAL AGENTS UNIV JOHNS HOPKINS (US) 2002-09-04 EP disclosed
EP-0738107-A4 INHIBITORS OF FATTY ACID SYNTHESIS AS ANTIMICROBIAL AGENTS UNIV JOHNS HOPKINS (US) 1998-09-09 EP disclosed
US-5710174-A ANTICOAGULANTS FOR BLOOD DISORDERS ZYMO GENETICS, INC. (US) 1998-01-20 US disclosed
WO-1997002340-A2 METHODS FOR INHIBITING FACTOR XIII ACTIVITY ZYMOGENETICS, INC. (US) 1997-01-23 WO disclosed
WO-1996040671-A1 CIS-RESORCYLIDE, PHARMACEUTICAL COMPOSITION CONTAINING IT, USE THEREOF IN THE TREATMENT OF THROMBOSIS AND RELATED DISORDERS ZYMOGENETICS, INC. (US) 1996-12-19 WO disclosed
EP-0738107-A1 INHIBITORS OF FATTY ACID SYNTHESIS AS ANTIMICROBIAL AGENTS THE JOHNS HOPKINS UNIVERSITY (US) 1996-10-23 EP disclosed
WO-1995019706-A1 INHIBITORS OF FATTY ACID SYNTHESIS AS ANTIMICROBIAL AGENTS THE JOHNS HOPKINS UNIVERSITY (US) 1995-07-27 WO disclosed
US-5188830-A Intravenous administration of Factor XIIIa inhibitor MERCK & CO., INC. (US) 1993-02-23 US disclosed
US-5185149-A Intravenously administering an acyloxiranecarboxylic acid compound factor XIII inhibitor to lyse clots MERCK & CO., INC. (US) 1993-02-09 US disclosed
US-4968494-A FACTOR VIIIA INHIBITOR MERCK & CO., INC. (US) 1990-11-06 US disclosed
EP-0294016-A2 Factor XIIIa inhibitor compounds useful for thrombolytic therapy MERCK & CO. INC. (US) 1988-12-07 EP 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 (2 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-20090325877-A1 Combination Product of Receptor Tyrosine Kinase Inhibitor and Fatty Acid Synthase Inhibitor for Treating Cancer FASN, FRS2, FGFR1 ALDH1A1 942/4885F13A1 1952/4885MAPT 4597/4885
US-20070142456-A1 Method for inhibiting cancer development by fatty acid synthase inhibitors FASN, SCD, FADS2 ALDH1A1 549/4885F13A1 1162/4885MAPT 4570/4885

“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.