SCHEMBL8991245

SCHEMBL8991245

Cc1ccccc1Cn1cc(C(N)=[Se])c2c(N)ncnc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 6/20 0.40
EGFR P00533 3/20 0.40
CDK1 P06493 1/20 0.40
PIK3CD O00329 4/20 0.40
KDM4E B2RXH2 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
HSD17B10 Q99714 1/20 0.39
RIPK2 O43353 1/20 0.39
ABL1 P00519 2/20 0.38
ABL2 P42684 1/20 0.38
LMNA P02545 1/20 0.38
HPGD P15428 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
EIF2AK3 Q9NZJ5 1/20 0.37
MAP4K4 O95819 1/20 0.37
LCK P06239 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
SCHEMBL7700881 0.88 CFD (0.45) SRCEGFRCDK1PIK3CDKDM4E
SCHEMBL7704461 0.88 HTT (0.42) SRCEGFRCDK1PIK3CDKDM4E
SCHEMBL8991225 0.85 PDE4A (0.42) SRCEGFRTSHRHTTABL1
SCHEMBL8991292 0.83 ADORA2A (0.51) SRCEGFRCDK1PIK3CDKDM4E
SCHEMBL8991019 0.81 KDM4E (0.41) SRCEGFRKDM4ETSHRMAPK1
SCHEMBL8991101 0.80 RIPK2 (0.42) SRCEGFRCDK1PIK3CDKDM4E
SCHEMBL8991256 0.79 KDM4E (0.40) SRCEGFRCDK1PIK3CDKDM4E
SCHEMBL7704465 0.79 EIF2AK3 (0.40) SRCEGFRCDK1PIK3CDKDM4E
SCHEMBL7702542 0.78 CFD (0.43) SRCEGFRCDK1PIK3CDKDM4E
SCHEMBL8991123 0.77 KDM4E (0.44) SRCEGFRCDK1PIK3CDKDM4E

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-5543413-A VIRAL ACTIVITY AGAINST HUMAN CYTOMEGALOVIRUS AND HERPES SIMPLEX VIRUS REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 1996-08-06 US disclosed