SCHEMBL8103067

SCHEMBL8103067

CCCNc1nc2ccccc2n2ccnc12

nearest known ligand 0.73

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 7/20 0.73
LCK P06239 1/20 0.59
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
TOP2A P11388 1/20 0.55
HTR3E A5X5Y0 1/20 0.51
HTR3B O95264 1/20 0.51
HTR3A P46098 1/20 0.51
HTR3D Q70Z44 1/20 0.51
HTR3C Q8WXA8 1/20 0.51
IKBKB O14920 1/20 0.47
MAPK1 P28482 1/20 0.44
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
THRB P10828 1/20 0.42

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
SCHEMBL11500648 0.91 MAPK8 (0.68) MAPK8LCKMEN1KMT2ARXFP1
SCHEMBL8118265 0.86 MAPK8 (0.73) MAPK8TOP2AHTR3EHTR3BHTR3A
SCHEMBL2816993 0.81 IKBKB (0.68) MAPK8TOP2AHTR3EHTR3BHTR3A
SCHEMBL17895299 0.81 MAPK8 (0.69) MAPK8MEN1KMT2ARXFP1TOP2A
SCHEMBL11500427 0.80 MAPK8 (0.67) MAPK8MEN1KMT2ATOP2AHTR3E
SCHEMBL14044179 0.79 MAPK8 (0.48) MAPK8LCKMEN1KMT2ARXFP1
SCHEMBL17895250 0.79 MAPK8 (0.66) MAPK8TOP2A
SCHEMBL22099666 0.79 MAPK8 (0.69) MAPK8HTR3EHTR3BHTR3AHTR3D
SCHEMBL8110850 0.79 MAPK8 (0.64) MAPK8TOP2AHTR3EHTR3BHTR3A
SCHEMBL17895204 0.78 MAPK8 (0.65) MAPK8

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