SCHEMBL8101449

SCHEMBL8101449

CN1c2cccnc2N(C)c2cccnc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 2/20 0.40
ADORA3 P0DMS8 1/20 0.40
ADORA2A P29274 1/20 0.40
ADORA1 P30542 1/20 0.40
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KMT2A Q03164 3/20 0.35
MEN1 O00255 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
NOS3 P29474 1/20 0.34
NOS1 P29475 1/20 0.34
NOS2 P35228 1/20 0.34
MAOA P21397 1/20 0.34
NPC1 O15118 1/20 0.34
HSP90AA1 P07900 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
EPHX2 P34913 1/20 0.34
GAA P10253 1/20 0.34

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
SCHEMBL8103219 0.93 ADORA3 (0.39) MYCADORA3ADORA2AADORA1LMNA
SCHEMBL8107564 0.83 ADRA2A (0.47) LMNAKMT2AMEN1ADRA2AADRA2B
SCHEMBL8103434 0.83 ADRA2A (0.34) MYCADORA3ADORA2AADORA1LMNA
SCHEMBL25816088 0.82 MYC (0.37) MYCADORA3ADORA2AADORA1LMNA
SCHEMBL22883432 0.82 MYC (0.34) MYCADORA3ADORA2AADORA1LMNA
SCHEMBL8107609 0.80 BRD4 (0.36) MYCKMT2AMEN1ADRA2AADRA2B
SCHEMBL8101458 0.79 GRM5 (0.33) ADORA3ADORA2AADORA1L3MBTL1
SCHEMBL8109276 0.79 ALDH1A1 (0.46) MYCADORA3ADORA2AADORA1LMNA
SCHEMBL7468232 0.78 ADRA2A (0.33) ADORA3ADORA2AADORA1LMNASMN1; SMN2
SCHEMBL8103233 0.77 KDM4E (0.40) LMNASMN1; SMN2L3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6127369-A 5,10-dihydrodipyrido[2,3-b:2,3-e]pyrazin and 5,10-dihydrodipyrido[2,3-b:3,2-e]pyrazin compounds ADIR ET COMPAGNIE (FR) 2000-10-03 US disclosed