SCHEMBL8558986

SCHEMBL8558986

CCOC(=O)c1ncn(-c2ccccc2N)c1C

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GABRG2 P18507 10/20 0.51
GABRB3 P28472 10/20 0.51
GABRA5 P31644 10/20 0.51
GABRA2 P47869 2/20 0.51
GABRA1 P14867 2/20 0.51
GABRA3 P34903 2/20 0.51
ALDH1A1 P00352 2/20 0.49
HSD17B10 Q99714 2/20 0.49
GABRB2 P47870 1/20 0.47
KDM4E B2RXH2 1/20 0.44
HPGD P15428 1/20 0.44
TP53 P04637 1/20 0.44
ALOX12 P18054 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
SCHEMBL16935799 0.84 GABRG2 (0.51) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL8895490 0.81 KMT2A (0.50) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL4963197 0.81 TP53 (0.58) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL21621661 0.81 GABRG2 (0.47) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL7508053 0.80 MAPT (0.47) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL21979193 0.78 PDE4D (0.53) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL14692520 0.78 PDE4B (0.46) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL28685593 0.77 PDE4B (0.50) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL23611832 0.77 BRD4 (0.45) GABRG2GABRB3GABRA5GABRA2GABRA1
SCHEMBL11887387 0.77 GABRG2 (0.44) GABRG2GABRB3GABRA5GABRA2GABRA1

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-1041928-C Imidazoloquinoxalinone derivatives as eaa antagonists BASF AG (DE) 1999-02-03 CN disclosed
EP-0691970-B1 IMIDAZOLOQUINOXALINONE DERIVATIVES AS EAA ANTAGONISTS BASF AG (DE) 1998-11-11 EP disclosed
CN-1120336-A Imidazoloquinoxalinone derivatives as eaa antagonists BASF AG (DE) 1996-04-10 CN disclosed
EP-0691970-A1 IMIDAZOLOQUINOXALINONE DERIVATIVES AS EAA ANTAGONISTS BASF AKTIENGESELLSCHAFT (DE) 1996-01-17 EP disclosed
WO-1994022865-A1 IMIDAZOLOQUINOXALINONE DERIVATIVES AS EAA ANTAGONISTS BASF AKTIENGESELLSCHAFT (DE) 1994-10-13 WO disclosed