SCHEMBL2638020

SCHEMBL2638020

CCOC(=O)CC(=O)c1cc(Cl)cc(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
KDM4E B2RXH2 1/20 0.59
ALDH1A1 P00352 1/20 0.59
MGAM O43451 1/20 0.48
GAA P10253 1/20 0.48
SI P14410 1/20 0.48
MGAM2 Q2M2H8 1/20 0.48
HPGD P15428 1/20 0.47
SMN1; SMN2 Q16637 2/20 0.45
ABCB1 P08183 1/20 0.42
PKM P14618 1/20 0.42
RAB9A P51151 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TPMT P51580 1/20 0.41
TSHR P16473 1/20 0.41
CNR2 P34972 1/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 1/20 0.39
MIF P14174 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
SCHEMBL1167517 0.83 ERCC5 (0.58) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL11830121 0.83 L3MBTL1 (0.50) MEN1KMT2AKDM4EALDH1A1MGAM
SCHEMBL276803 0.82 SMN1; SMN2 (0.61) MEN1KMT2AKDM4EALDH1A1MGAM
SCHEMBL1167344 0.81 KDM4E (0.63) MEN1KMT2AKDM4EALDH1A1MGAM
SCHEMBL2459005 0.79 MEN1 (0.59) MEN1KMT2AKDM4EALDH1A1MGAM
SCHEMBL11622169 0.79 KDM4E (0.59) MEN1KMT2AKDM4EALDH1A1MGAM
SCHEMBL1348885 0.78 KDM4E (0.51) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL31299787 0.78 KDM4E (0.51) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL4263364 0.78 SMN1; SMN2 (0.56) MEN1KMT2AKDM4EALDH1A1HPGD
SCHEMBL1437391 0.78 MEN1 (0.48) MEN1KMT2AKDM4EALDH1A1HPGD

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
CN-116023263-A Synthesis method of intermediate 3- (3, 5-dichlorophenyl) -3-oxo-ethyl propionate 苏州汉德创宏生化科技有限公司 2023-04-28 CN claimed
CN-116023263-A Synthesis method of intermediate 3- (3, 5-dichlorophenyl) -3-oxo-ethyl propionate 苏州汉德创宏生化科技有限公司 2023-04-28 CN disclosed
EP-2440553-B1 THIOPHENES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE MERCK SHARP & DOHME (US) 2017-08-23 EP disclosed
US-8470773-B2 Thiophenes as glucagon receptor antagonists, compositions, and methods for their use MERCK SHARP & DOHME CORP. (US) 2013-06-25 US disclosed
US-8470773-B2 Thiophenes as glucagon receptor antagonists, compositions, and methods for their use MERCK SHARP & DOHME CORP. (US) 2013-06-25 US disclosed
US-20120108505-A1 THIOPHENES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE SCHERING CORPORATION 2012-05-03 US disclosed
US-20120108505-A1 THIOPHENES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE SCHERING CORPORATION 2012-05-03 US disclosed
EP-2438070-A1 GLYCINE B ANTAGONISTS Merz Pharma GmbH & Co. KGaA (DE) 2012-04-11 EP disclosed
US-20110065634-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE MERCK SHARP & DOHME LLC 2011-03-17 US disclosed
WO-2010139483-A1 GLYCINE B ANTAGONISTS MERZ PHARMA GMBH & CO. KGAA (DE) 2010-12-09 WO disclosed
US-7598285-B2 Pyrazole derivatives, compositions containing such compounds and methods of use MERCK & CO., INC (US) 2009-10-06 US disclosed
US-20080167322-A1 Substituted Pyrazoles as Modulators of Chemokine Receptors MERCK SHARP & DOHME CORP. 2008-07-10 US disclosed
EP-1853260-A1 SUBSTITUTED PYRAZOLES AS MODULATORS OF CHEMOKINE RECEPTORS Merck & Co., Inc. (US) 2007-11-14 EP disclosed
EP-1756064-A2 PYRAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE Merck & Co., Inc. (US) 2007-02-28 EP disclosed
WO-2006088813-A1 SUBSTITUTED PYRAZOLES AS MODULATORS OF CHEMOKINE RECEPTORS MERCK & CO., INC. (US) 2006-08-24 WO disclosed
WO-2005121097-A2 PYRAZOLE DERIVATIVES, COMPOSITIONS CONTAINING SUCH COMPOUNDS AND METHODS OF USE MERCK & CO., INC. (US) 2005-12-22 WO disclosed
US-20050272794-A1 Pyrazole derivatives, compositions containing such compounds and methods of use MERCK SHARP & DOHME LLC 2005-12-08 US disclosed
US-6544982-B1 3-aryl-5-aminoisoxazole derivatives MERCK & CO., INC. 2003-04-08 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 (4 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-20120108505-A1 THIOPHENES AS GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE GLP1R, GCGR, GPR119 MEN1 2146/4885KMT2A 3628/4885KDM4E 3526/4885
US-20050272794-A1 Pyrazole derivatives, compositions containing such compounds and methods of use PC, GOT2, PNLIP MEN1 3060/4885KMT2A 4218/4885KDM4E 4338/4885
US-20080167322-A1 Substituted Pyrazoles as Modulators of Chemokine Receptors CCR1, CCR3, CCR2 MEN1 4495/4885KMT2A 4288/4885KDM4E 4538/4885
US-20110065634-A1 GLUCAGON RECEPTOR ANTAGONISTS, COMPOSITIONS, AND METHODS FOR THEIR USE GLP1R, GCGR, GIPR MEN1 738/4885KMT2A 3064/4885KDM4E 3548/4885

“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.