SCHEMBL8991281

SCHEMBL8991281

COCCOCn1cc(C(N)=[Se])c2c(N)ncnc21

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ENPP1 P22413 2/20 0.39
RET P07949 10/20 0.37
SRC P12931 3/20 0.37
LCK P06239 1/20 0.37
TEK Q02763 1/20 0.37
FLT3 P36888 2/20 0.36
NT5E P21589 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
SCHEMBL7700383 0.88 NPC1 (0.43) ENPP1RETSRCLCKTEK
SCHEMBL7703236 0.86 ADK (0.38) RETSRCLCKTEKFLT3
SCHEMBL8991249 0.85 ADK (0.33) ENPP1SRCFLT3
SCHEMBL8991270 0.79 IGF1R (0.43) RETSRCLCKTEK
SCHEMBL8991287 0.78 FLT3 (0.40) ENPP1RETSRCLCKTEK
SCHEMBL7700384 0.78 ENPP1 (0.39) ENPP1RETSRCLCKTEK
SCHEMBL7701195 0.77 ADK (0.42) ENPP1RETSRCLCKTEK
SCHEMBL8991118 0.76 RET (0.38) ENPP1RET
SCHEMBL10388752 0.76 NPC1 (0.47) ENPP1SRCLCKTEKFLT3
SCHEMBL8440532 0.75 SRC (0.41) RETSRCLCKTEKFLT3

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