SCHEMBL8991124

SCHEMBL8991124

CCOCn1c(N)c(C(N)=[Se])c2c(N)ncnc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KB Q9UBF8 4/20 0.35
ADORA2A P29274 2/20 0.35
ADORA1 P30542 2/20 0.35
PI4KA P42356 2/20 0.35
PI4K2B Q8TCG2 2/20 0.35
PI4K2A Q9BTU6 2/20 0.35
KDM4E B2RXH2 1/20 0.34
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
SRC P12931 6/20 0.34
RET P07949 5/20 0.34
EGFR P00533 4/20 0.34
KDR P35968 4/20 0.34
ABL1 P00519 4/20 0.34
PIK3CD O00329 3/20 0.34
HCK P08631 3/20 0.34
PIK3CA P42336 3/20 0.34
PIK3CB P42338 3/20 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
SCHEMBL7701707 0.87 SRC (0.36) PI4KBADORA2AADORA1KDM4ETSHR
SCHEMBL8991118 0.86 RET (0.38) RET
SCHEMBL8991163 0.86 YTHDC1 (0.31) SRCEGFR
SCHEMBL8990961 0.82 KDM4E (0.44) PI4KBADORA2AADORA1PI4KAPI4K2B
SCHEMBL8991135 0.77 KDM4E (0.35) PI4KBADORA2AADORA1KDM4ETSHR
SCHEMBL7701709 0.77 RET (0.36) PI4KBKDM4ETSHRMAPK1HTT
SCHEMBL7697510 0.75 LRRK2 (0.58) PI4KBADORA2AADORA1PI4KAPI4K2B
SCHEMBL8991251 0.75 KDM4E (0.49) ADORA2AADORA1KDM4ETSHRMAPK1
SCHEMBL8991267 0.75 KDM4E (0.48) PI4KBPI4KAPI4K2BPI4K2AKDM4E
SCHEMBL7703236 0.74 ADK (0.38) PI4KBADORA2AADORA1PI4KAPI4K2B

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