SCHEMBL2769437

SCHEMBL2769437

O=Cc1cc(Cl)cc2ccccc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 8/20 0.47
TDP1 Q9NUW8 2/20 0.41
LMNA P02545 2/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
THRB P10828 1/20 0.41
BLM P54132 1/20 0.41
CYP2A6 P11509 4/20 0.40
MCL1 Q07820 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
IMPDH2 P12268 1/20 0.37
MAPT P10636 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
RXFP1 Q9HBX9 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HIF1A Q16665 1/20 0.37
CYP1B1 Q16678 1/20 0.37

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
SCHEMBL10488550 0.84 ERN1 (0.40) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL6413875 0.80 CYP2A6 (0.40) ERN1LMNACYP2A6MAPTHTT
SCHEMBL4866312 0.78 TDP1 (0.48) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL2996328 0.78 ERN1 (0.45) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL31141573 0.78 ERN1 (0.45) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL3676494 0.78 ERN1 (0.45) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL29953557 0.78 ERN1 (0.45) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL6582354 0.77 CYP2A6 (0.38) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL419485 0.77 ERN1 (0.51) ERN1TDP1LMNAMEN1KMT2A
SCHEMBL29388348 0.77 ERN1 (0.51) ERN1TDP1LMNAMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2203161-B1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF UNIV INDIANA RES & TECH CORP (US) 2018-05-09 EP disclosed
US-9089605-B2 Quinone derivatives, pharmaceutical compositions, and uses thereof INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2015-07-28 US disclosed
US-20100297113-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF PURDUE RESEARCH FOUNDATION 2010-11-25 US disclosed
EP-2203161-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF Indiana University Research and Technology Corporation (US) 2010-07-07 EP disclosed
EP-1753739-B1 IMIDAZOL-2-ONE COMPOUNDS USEFUL IN THE TREATMENT OF VARIOUS DISORDERS GLAXO GROUP LTD (GB) 2010-04-28 EP disclosed
CN-100534983-C Cyclic amine derivatives, processes for their preparation, and pharmaceutical compositions containing them GLAXO GROUP LTD (GB) 2009-09-02 CN disclosed
US-20090192194-A1 Cyclic Amine Derivatives, Processes For Their Preparation, And Pharmaceutical Compositions Containing Them ALVARO GIUSEPPE 2009-07-30 US disclosed
US-7534893-B2 Imidazol-2-one compounds useful in the treatment of various disorders GLAXO GROUP LIMITED (GB) 2009-05-19 US disclosed
WO-2009042544-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2009-04-02 WO disclosed
US-20080262041-A1 Beta-Lactams for Treatment of Cns Disorders GLAXO GROUP LIMITED (GB) 2008-10-23 US disclosed
EP-1169320-B1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2004-09-22 EP disclosed
CN-1151148-C farnesyl transferase inhibitor with pyrrole structure and preparation method thereof LGCI��ʽ���� 2004-05-26 CN disclosed
US-20040018956-A1 Aporphine esters and their use in therapy AXON BIOCHEMICALS B.V. (NL) 2004-01-29 US disclosed
EP-1309553-A1 NEW APORPHINE ESTERS AND THEIR USE IN THERAPY Axon Biochemicals B.V. (NL) 2003-05-14 EP disclosed
US-6511978-B1 For treating cancer, restenosis, atherosclerosis or viral infections LG LIFE SCIENCES, LTD. (KR) 2003-01-28 US disclosed
EP-1169320-A4 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD (KR) 2002-10-30 EP disclosed
CN-1346353-A farnesyl transferase inhibitor with pyrrole structure and preparation method thereof LG CHEMICAL LTD (KR) 2002-04-24 CN disclosed
WO-2002014279-A1 NEW APORPHINE ESTERS AND THEIR USE IN THERAPY AXON BIOCHEMICALS B.V. (NL) 2002-02-21 WO disclosed
EP-1169320-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG Chem Investment, Ltd. (KR) 2002-01-09 EP disclosed
WO-2000064891-A1 FARNESYL TRANSFERASE INHIBITORS HAVING A PYRROLE STRUCTURE AND PROCESS FOR PREPARATION THEREOF LG CHEM INVESTMENT LTD. (KR) 2000-11-02 WO 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-20080262041-A1 Beta-Lactams for Treatment of Cns Disorders SLC7A1, TPH1, CHRNA10 ERN1 2613/4885TDP1 1946/4885LMNA 4098/4885
US-20090192194-A1 Cyclic Amine Derivatives, Processes For Their Preparation, And Pharmaceutical Compositions Containing Them SLC6A4, OPRL1, HCRTR1 ERN1 3505/4885TDP1 3828/4885LMNA 4130/4885
US-20100297113-A1 QUINONE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF APEX1, NQO1, REV1 ERN1 676/4885TDP1 118/4885LMNA 4347/4885
US-20040018956-A1 Aporphine esters and their use in therapy PRLHR, LPXN, NPSR1 ERN1 3761/4885TDP1 519/4885LMNA 1681/4885

“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.