SCHEMBL8991126

SCHEMBL8991126

COCCOCn1c(N)c([Se]C(N)=O)c2c(N)ncnc21

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RET P07949 14/20 0.36
ENPP1 P22413 1/20 0.35
MET P08581 1/20 0.35
FLT3 P36888 1/20 0.34
RPS6KA3 P51812 1/20 0.34
KDR P35968 1/20 0.34
KDM4E B2RXH2 1/20 0.33
TSHR P16473 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL8991178 0.88 RET (0.31) RETMETFLT3KDR
SCHEMBL8991135 0.87 KDM4E (0.35) RETFLT3RPS6KA3KDRKDM4E
SCHEMBL8990968 0.81 KDM4E (0.42) RETKDRKDM4ETSHRMAPK1
SCHEMBL7703321 0.80 RET (0.38) RETENPP1RPS6KA3
SCHEMBL8991118 0.78 RET (0.38) RETENPP1
SCHEMBL7703318 0.78 RET (0.39) RETKDR
SCHEMBL8991287 0.78 FLT3 (0.40) RETENPP1FLT3
SCHEMBL8991284 0.76 KDM4E (0.44) RETKDRKDM4ETSHRMAPK1
SCHEMBL8991176 0.76 XDH (0.31)
SCHEMBL8991058 0.74 MAPK1 (0.55) KDRKDM4ETSHRMAPK1HTT

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