SCHEMBL7217070

SCHEMBL7217070

CNC(=O)Cn1c(=O)n(C)c2nc(-c3ccccc3)ncc21

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSPO P30536 1/20 0.53
LMNA P02545 1/20 0.44
GRIN1 Q05586 3/20 0.43
GRIN2B Q13224 3/20 0.43
TSHR P16473 1/20 0.42
THRB P10828 2/20 0.42
HDAC6 Q9UBN7 1/20 0.42
GRM2 Q14416 1/20 0.41
TRPA1 O75762 1/20 0.41
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL7212081 0.89 LMNA (0.60) TSPOLMNATSHRTHRB
SCHEMBL7210797 0.88 TSPO (0.57) TSPOGRIN1GRIN2BGRM2
SCHEMBL7216925 0.82 TSPO (0.56) TSPOLMNAGRIN1GRIN2BTSHR
SCHEMBL7215601 0.81 TSPO (0.58) TSPOGRIN1GRIN2B
SCHEMBL6482823 0.80 TSPO (0.61) TSPOGRIN1GRIN2B
SCHEMBL7215395 0.80 TSPO (0.67) TSPOGRIN1GRIN2B
Hydrochloric Acid SCHEMBL7212073 0.79 TSPO (0.60) TSPOGRIN1GRIN2B
SCHEMBL6483612 0.78 TSPO (0.85) TSPOGRIN1GRIN2B
SCHEMBL7667245 0.78 GRIN1 (0.49) TSPOGRIN1GRIN2BTSHRPOLB
SCHEMBL7216373 0.78 TSPO (0.55) TSPOGRIN1GRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1146566-C 2-aryl-8-oxodihydropurine derivatives, process for producting same, medicinal conty. same, and intermediates thereof �ձ���ҩ��ʽ���� 2004-04-21 CN disclosed
EP-1036794-B1 2-ARYL-8-OXODIHYDROPURINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME, AND INTERMEDIATES THEREOF DAINIPPON PHARMACEUTICAL CO (JP) 2003-08-27 EP disclosed
US-6372740-B1 NERVOUS SYSTEM DISORDERS, ANTIEPILEPTIC AGENTS AND ANTIDEPRESSANTS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 2002-04-16 US disclosed
CN-1284076-A 2-aryl-8-oxodihydropurine derivatives, process for producting same, medicinal conty. same, and intermediates thereof DAINIPPON PHARMACEUTICAL CO (JP) 2001-02-14 CN disclosed
EP-1036794-A1 2-ARYL-8-OXODIHYDROPURINE DERIVATIVES, PROCESS FOR PRODUCING THE SAME, MEDICINAL COMPOSITIONS CONTAINING THE SAME, AND INTERMEDIATES THEREOF Dainippon Pharmaceutical Co., Ltd. (JP) 2000-09-20 EP disclosed