SCHEMBL365437

SCHEMBL365437

C=Nc1c(C(C)C)cccc1C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.48
GABRG2 P18507 2/20 0.48
GABRB3 P28472 2/20 0.48
GABRB2 P47870 2/20 0.48
LMNA P02545 2/20 0.48
FAAH O00519 1/20 0.48
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
HPGD P15428 1/20 0.48
TSHR P16473 1/20 0.48
GABRB1 P18505 1/20 0.48
PTGS1 P23219 1/20 0.48
SLC6A2 P23975 1/20 0.48
HTR2C P28335 1/20 0.48
GABRA5 P31644 1/20 0.48
GABRA3 P34903 1/20 0.48
HTR2B P41595 1/20 0.48
GABRA2 P47869 1/20 0.48

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
SCHEMBL27396768 0.83 GABRA1 (0.39) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL24022546 0.79 GABRA1 (0.52) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL21348074 0.79 GABRA1 (0.35) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL21367389 0.79 GABRA1 (0.35) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL23685898 0.79 SIGMAR1 (0.37) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL134760 0.78 GABRA1 (0.46) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL8755372 0.75 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL4398016 0.75 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL16919083 0.75 GABRA1 (0.48) GABRA1GABRG2GABRB3GABRB2LMNA
SCHEMBL24835479 0.75 GABRA1 (0.35) GABRA1GABRG2GABRB3GABRB2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260076021-A1 EMITTER MATERIAL FOR OLEDS UNIV DORTMUND TECH (DE) 2026-03-12 US disclosed
EP-4581037-A1 EMITTER MATERIAL FOR OLEDS Technische Universität Dortmund (DE) 2025-07-09 EP disclosed
WO-2024046539-A1 EMITTER MATERIAL FOR OLEDS TECHNISCHE UNIVERSITÄT DORTMUND (DE) 2024-03-07 WO disclosed
CN-114031519-A Method for synthesizing N-aryl imine 浙江工业大学 2022-02-11 CN disclosed
WO-2021219999-A1 AUTOMATED CHEMICAL SYNTHESIS PLATFORM THE UNIVERSITY COURT OF THE UNIVERSITY OF GLASGOW (GB) 2021-11-04 WO disclosed
WO-2016170328-A1 TUNGSTEN CATALYSTS OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2016-10-27 WO disclosed
EP-2311112-B1 ELECTRONIC DEVICES COMPRISING METAL COMPLEXES HAVING ISONITRILE LIGANDS MERCK PATENT GMBH (DE) 2012-03-14 EP disclosed
US-20110101327-A1 Electronic Devices Comprising Metal Complexes Having Isonitrile Ligands MERCK PATENT GMBH (DE) 2011-05-05 US disclosed
WO-2010015307-A1 ELECTRONIC DEVICES COMPRISING METAL COMPLEXES HAVING ISONITRILE LIGANDS MERCK PATENT GMBH (DE) 2010-02-11 WO disclosed
US-7612245-B2 converting 1,3-butadiene to cis-2-butene in presence of a hydrogenation catalyst mixture containing iron octanoate, triethylaluminium, 2,3-bis(2,6-dimethylphenylimino)butane; catalyst selectivity INSTITUT FRANCAIS DU PETROLE (FR) 2009-11-03 US disclosed
US-20070082918-A1 NEUROLOGICALLY ACTIVE COMPOUNDS AND COMPOUNDS WITH MULTIPLE ACTIVITIES NAFTCHI N E 2007-04-12 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 (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-20110101327-A1 Electronic Devices Comprising Metal Complexes Having Isonitrile Ligands EXOC4, ICMT, NCLN GABRA1 1035/4885GABRG2 902/4885GABRB3 870/4885
US-20070082918-A1 NEUROLOGICALLY ACTIVE COMPOUNDS AND COMPOUNDS WITH MULTIPLE ACTIVITIES ADRB2, ADRB1, CHRNA7 GABRA1 41/4885GABRG2 74/4885GABRB3 24/4885
US-20260076021-A1 EMITTER MATERIAL FOR OLEDS NR1H2, NR1H3, CNR1 GABRA1 3528/4885GABRG2 3456/4885GABRB3 2959/4885

“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.