SCHEMBL460545

SCHEMBL460545

C1=C2CCCC=C2N=c2ccccc2=C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.31
GRM5 P41594 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL869746 0.70
SCHEMBL9716940 0.68
SCHEMBL10768329 0.67
SCHEMBL14742396 0.60
SCHEMBL560767 0.59
SCHEMBL28758944 0.59 PTGS2 (0.51) TDP1
SCHEMBL360448 0.59 ACMSD (0.47) TDP1
SCHEMBL15973332 0.58
SCHEMBL2988908 0.58 GRM2 (0.31) TDP1
SCHEMBL30767406 0.57 CHRNB4 (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024134517-A1 NOVEL COMPOUND AS RON INHIBITOR 주식회사 엘지화학 2024-06-27 WO disclosed
WO-2024134516-A1 NOVEL COMPOUND AS RON INHIBITOR 주식회사 엘지화학 2024-06-27 WO disclosed
WO-2024025260-A1 FLUORESCENT PROBE COMPOUND AND COMPOSITE COMPRISING SAME 한국생명공학연구원 2024-02-01 WO disclosed
WO-2022235077-A1 NOVEL SIDEROPHORE COMPOUND AND METAL NANOPARTICLE COMPLEX USING SAME 한국생명공학연구원 2022-11-10 WO disclosed
WO-2022211314-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, MANUFACTURING METHOD THEREFOR, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2022-10-06 WO disclosed
WO-2022186645-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, MANUFACTURING METHOD THEREFOR, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2022-09-09 WO disclosed
US-11302873-B2 Organic light-emitting device LT MATERIALS CO, LTD. (KR) 2022-04-12 US disclosed
EP-0751129-B3 Substituted dihydrodibenzo(b,f)azepines, method for their preparation, their use in the treatment of some central nervous system disorders, and pharmaceutical compositions containing them BIAL PORTELA & CA SA (PT) 2020-05-13 EP disclosed
US-20120022047-A1 PROCESS FOR THE PURIFICATION OF ESLICARBAZEPINE ACETATE GLENMARK GENERICS LTD (IN) 2012-01-26 US disclosed
US-7863443-B2 Phosphoramidite ligand and production method of allylic amine using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-01-04 US disclosed
US-20090054689-A1 PHOSPHORAMIDITE LIGAND AND PRODUCTION METHOD OF ALLYLIC AMINE USING THE SAME Carreira, Erick M. (CH) 2009-02-26 US disclosed
US-20060142566-A1 Enantioselective process for the preparation of both enantiomers of 10,11-dihydro-10-hydroxy-5h-dibenz[b,f]azepine-5-carboxamide and new crystal forms thereof NOVARTIS AG (CH) 2006-06-29 US disclosed
EP-1551808-A1 ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF BOTH ENANTIOMERS OF 10,11-DIHYDRO-10-HYDROXY-5H-DIBENZ b,f AZEPINE-5-CARBOXAMIDE AND NEW CRYSTAL FORMS THEREOF Novartis AG (CH) 2005-07-13 EP disclosed
EP-1551808-A1 ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF BOTH ENANTIOMERS OF 10,11-DIHYDRO-10-HYDROXY-5H-DIBENZ b,f AZEPINE-5-CARBOXAMIDE AND NEW CRYSTAL FORMS THEREOF Novartis AG (CH) 2005-07-13 EP disclosed
EP-1414806-A1 NOVEL VINYL N-(2-BENZOYLPHENYL)-L-TYROSINE DERIVATIVES AND THEIR USE AS ANTIDIABETICS ETC NOVO NORDISK A/S (DK) 2004-05-06 EP disclosed
WO-2004031155-A1 ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF BOTH ENANTIOMERS OF 10,11-DIHYDRO-10-HYDROXY-5H-DIBENZ [b,f]AZEPINE-5-CARBOXAMIDE AND NEW CRYSTAL FORMS THEREOF NOVARTIS AG (CH) 2004-04-15 WO disclosed
WO-2004031155-A1 ENANTIOSELECTIVE PROCESS FOR THE PREPARATION OF BOTH ENANTIOMERS OF 10,11-DIHYDRO-10-HYDROXY-5H-DIBENZ [b,f]AZEPINE-5-CARBOXAMIDE AND NEW CRYSTAL FORMS THEREOF NOVARTIS AG (CH) 2004-04-15 WO disclosed
WO-2003011834-A1 NOVEL VINYL N-(2-BENZOYLPHENYL)-L-TYROSINE DERIVATIVES AND THEIR USE AS ANTIDIABETICS ETC NOVO NORDISK A/S (DK) 2003-02-13 WO disclosed
EP-0751129-B1 Substituted dihydrodibenzo(b,f)azepines, method for their preparation, their use in the treatment of some central nervous system disorders, and pharmaceutical compositions containing them PORTELA & CA SA (PT) 1998-11-18 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 (3 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-20090054689-A1 PHOSPHORAMIDITE LIGAND AND PRODUCTION METHOD OF ALLYLIC AMINE USING THE SAME ADH5, SELENOI, ADH1A CYP1A2 1817/4885GRM5 395/4885TDP1 4379/4885
US-20120022047-A1 PROCESS FOR THE PURIFICATION OF ESLICARBAZEPINE ACETATE CACNA1A, GABRE, CACNA1D CYP1A2 309/4885GRM5 425/4885TDP1 4490/4885
US-20060142566-A1 Enantioselective process for the preparation of both enantiomers of 10,11-dihydro-10-hydroxy-5h-dibenz[b,f]azepine-5-carboxamide and new crystal forms thereof HRH4, HRH1, HRH3 CYP1A2 11/4885GRM5 922/4885TDP1 4132/4885

“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.