SCHEMBL8118650

SCHEMBL8118650

Clc1cc2nc(Cl)c3nccn3c2cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2D O15399 1/20 0.49
GRIN3B O60391 1/20 0.49
GRIA1 P42261 1/20 0.49
GRIA2 P42262 1/20 0.49
GRIA3 P42263 1/20 0.49
GRIA4 P48058 1/20 0.49
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GRIN3A Q8TCU5 1/20 0.49
KDM4E B2RXH2 4/20 0.46
ALDH1A1 P00352 2/20 0.46
HPGD P15428 2/20 0.46
MAPT P10636 2/20 0.46
MEN1 O00255 1/20 0.46
NPC1 O15118 1/20 0.46
GLA P06280 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL119071 0.83 HTR3E (0.39) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL124220 0.83 IKBKB (0.43) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL8102963 0.80 CUL4A (0.51) KDM4EALDH1A1HPGDNPC1GLA
SCHEMBL3496046 0.78 HTR3E (0.40) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL121472 0.78 HTR3E (0.45) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL24832295 0.78 IKBKB (0.45) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL30973203 0.78 IKBKB (0.45) GRIN2DGRIN3BGRIA1GRIA2GRIA3
SCHEMBL13077027 0.78 IKBKB (0.66) KDM4EALDH1A1MAPTMEN1POLB
SCHEMBL120846 0.76 MAPK8 (0.54) KDM4EALDH1A1HPGDMEN1GLA
SCHEMBL30578099 0.76 MAPK8 (0.54) KDM4EALDH1A1HPGDMEN1GLA

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
US-6124287-A TREATING DEPRESSION BIOMEDICA FOSCAMA INDUSTRIA CHIMICOFARMACEUTICA S.P.A. (IT) 2000-09-26 US disclosed
EP-0865442-B1 IMIDAZO[1,2-a]QUINOXALIN-4-AMINES ACTIVE AS ADENOSINE ANTAGONISTS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS THEREOF FOSCAMA BIOMED CHIM FARMA (IT) 2000-07-05 EP disclosed