SCHEMBL9044264

SCHEMBL9044264

Cn1c(=O)c2nc(C=O)cn2c2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA5 P31644 1/20 0.45
ADORA3 P0DMS8 5/20 0.40
FGFR1 P11362 1/20 0.38
KDM4E B2RXH2 4/20 0.38
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
GAA P10253 2/20 0.38
HPGD P15428 2/20 0.38
MAPT P10636 4/20 0.38
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
LMNA P02545 1/20 0.38
POLB P06746 1/20 0.38
MAPK1 P28482 1/20 0.38
DAO P14920 1/20 0.37
PKM P14618 1/20 0.36
ADORA1 P30542 1/20 0.36
IMPDH2 P12268 1/20 0.35

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
SCHEMBL10728827 0.81 GABRA5 (0.49) GABRA5ADORA3KDM4EALDH1A1SMN1; SMN2
SCHEMBL3590577 0.81 MBD2 (0.47) GABRA5KDM4EALDH1A1SMN1; SMN2GAA
SCHEMBL9043651 0.80 GABRA5 (0.49) GABRA5ADORA3KDM4EALDH1A1SMN1; SMN2
SCHEMBL11403965 0.75 ADORA3 (0.46) GABRA5ADORA3KDM4EALDH1A1GAA
SCHEMBL11402491 0.69 ADORA3 (0.60) GABRA5ADORA3KDM4EALDH1A1GAA
SCHEMBL28858361 0.69 ALDH1A1 (0.35) KDM4EALDH1A1SMN1; SMN2HPGDMAPT
SCHEMBL29993425 0.69 ALDH1A1 (0.35) KDM4EALDH1A1SMN1; SMN2HPGDMAPT
SCHEMBL31093975 0.68 GABRA5 (0.55) GABRA5ADORA3KDM4EALDH1A1SMN1; SMN2
SCHEMBL1278798 0.68 GABRA5 (0.55) GABRA5ADORA3KDM4EALDH1A1SMN1; SMN2
SCHEMBL25857423 0.67 TOP2A (0.51) KDM4EALDH1A1SMN1; SMN2GAAHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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