SCHEMBL9114558

SCHEMBL9114558

NC(=O)c1nc2ccccc2nc1C=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.48
SMN1; SMN2 Q16637 3/20 0.48
ALDH1A1 P00352 3/20 0.48
MAP2K3 P46734 2/20 0.42
LCK P06239 1/20 0.42
MAP2K6 P52564 1/20 0.42
BTK Q06187 1/20 0.42
MAP3K19 Q56UN5 1/20 0.42
NEK10 Q6ZWH5 1/20 0.42
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
HTT P42858 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
IKBKB O14920 3/20 0.39
ADORA2A P29274 1/20 0.38
HSD17B10 Q99714 4/20 0.36
KDM4E B2RXH2 2/20 0.36
PPARG P37231 1/20 0.36
NCOA2 Q15596 1/20 0.36

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
SCHEMBL11233390 0.83 ALDH1A1 (0.67) MAPTSMN1; SMN2ALDH1A1MEN1NPC1
SCHEMBL28296154 0.75 ALDH1A1 (0.79) MAPTSMN1; SMN2ALDH1A1MAP2K3LCK
SCHEMBL43146 0.75 MAPT (0.54) MAPTSMN1; SMN2ALDH1A1MAP2K3LCK
SCHEMBL4101721 0.75 ALDH1A1 (0.56) MAPTSMN1; SMN2ALDH1A1MAP2K3LCK
SCHEMBL3574871 0.73 TDP1 (0.54) MAPTSMN1; SMN2ALDH1A1MAP2K3LCK
SCHEMBL29956691 0.72 MAPT (0.58) MAPTSMN1; SMN2ALDH1A1MEN1NPC1
SCHEMBL5101956 0.72 MAPT (0.44) MAPTSMN1; SMN2ALDH1A1MEN1NPC1
SCHEMBL28218325 0.72 MAPT (0.58) MAPTSMN1; SMN2ALDH1A1MEN1NPC1
SCHEMBL1332157 0.70 MAP2K3 (0.50) MAPTSMN1; SMN2ALDH1A1MAP2K3LCK
SCHEMBL30643071 0.70 ALDH1A1 (0.53) MAPTSMN1; SMN2ALDH1A1MAP2K3MEN1

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-0670831-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1995-09-13 EP disclosed
WO-1995009159-A1 QUINOXALINE DERIVATIVE AS ANTIDIABETIC AGENT OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) 1995-04-06 WO disclosed