SCHEMBL2650737

SCHEMBL2650737

c1ccc(-c2cnc3ncccn23)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.77
DYRK1A Q13627 2/20 0.53
PKM P14618 5/20 0.51
KDR P35968 4/20 0.50
CCNK O75909 1/20 0.50
CDK12 Q9NYV4 1/20 0.50
GAA P10253 1/20 0.46
KDM4E B2RXH2 1/20 0.46
ALDH1A1 P00352 1/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
HSD17B10 Q99714 1/20 0.46
FLT3 P36888 3/20 0.45
CHEK1 O14757 2/20 0.44
MAP4K4 O95819 1/20 0.44
CSF1R P07333 1/20 0.44
PRKACA P17612 1/20 0.44
CDK8 P49336 1/20 0.44
MAP2K1 Q02750 1/20 0.44
ACVR1 Q04771 1/20 0.44

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
SCHEMBL14982444 0.85 BACE1 (0.62) BACE1DYRK1APKMKDRCCNK
SCHEMBL25296092 0.84 BACE1 (0.70) BACE1DYRK1APKMCCNKCDK12
SCHEMBL18226933 0.80 BACE1 (0.64) BACE1DYRK1APKMCCNKCDK12
SCHEMBL22394780 0.79 BACE1 (0.67) BACE1DYRK1APKMCCNKCDK12
SCHEMBL5259449 0.78 BACE1 (0.64) BACE1DYRK1APKMGAAKDM4E
SCHEMBL7226061 0.77 GABRG2 (0.70) BACE1
SCHEMBL7317298 0.75 BACE1 (0.57) BACE1DYRK1APKMCCNKCDK12
SCHEMBL2650330 0.74 FLT3 (0.74) DYRK1APKMKDRFLT3CHEK1
SCHEMBL6219215 0.74 BACE1 (0.55) BACE1DYRK1APKMFLT3PIK3CA
SCHEMBL6219838 0.73 BACE1 (0.61) BACE1DYRK1APKMKDRCCNK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10930853-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2021-02-23 US disclosed
US-9818960-B2 Condensed cyclic compound and organic light-emitting device including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-11-14 US disclosed
US-20170155048-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2017-06-01 US disclosed
US-9012042-B2 Condensed-cyclic compound, organic light-emitting device comprising the same, and flat panel display apparatus SAMSUNG DISPLAY CO., LTD. (KR) 2015-04-21 US disclosed
US-20120286246-A1 CONDENSED-CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, AND FLAT PANEL DISPLAY APPARATUS SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-11-15 US disclosed
CN-1294133-C Imidazo-pyrimidine derivatives as ligands for GABA receptors MERCK SHARP & DOHME (GB) 2007-01-10 CN disclosed
EP-1381606-B1 IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME (GB) 2005-07-20 EP disclosed
CN-1498218-A Imidazo-pyrimidine derivatives as GABA receptor ligands Ĭ�ˡ�����-��ķ��˾ 2004-05-19 CN disclosed
EP-1381606-A1 IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LTD. (GB) 2004-01-21 EP disclosed
US-6642229-B2 Treatment of adverse neurological conditions MERCK SHARP & DOHME LTD. 2003-11-04 US disclosed
WO-2002074773-A1 IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2002-09-26 WO disclosed
WO-2002074772-A1 IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2002-09-26 WO disclosed
WO-2001090108-A1 3-PHENYL-IMIDAZO-PYRIMIDINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS MERCK SHARP & DOHME LIMITED (GB) 2001-11-29 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 (1 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-20120286246-A1 CONDENSED-CYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME, AND FLAT PANEL DISPLAY APPARATUS OR10J3, AR, ARL1 BACE1 1992/4885DYRK1A 4730/4885PKM 4427/4885

“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.