SCHEMBL8991004

SCHEMBL8991004

CCOCn1c(N)c(C(N)=S)c2c(NC)ncnc21

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
YTHDC1 Q96MU7 1/20 0.31
EGFR P00533 1/20 0.30
SRC P12931 1/20 0.30

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
SCHEMBL8991163 0.88 YTHDC1 (0.31) YTHDC1EGFRSRC
SCHEMBL8991290 0.87 RET (0.33)
SCHEMBL7701707 0.86 SRC (0.36) EGFRSRC
SCHEMBL8991214 0.85 EGFR (0.38) EGFRSRC
SCHEMBL8991012 0.78 XDH (0.33)
SCHEMBL8991176 0.78 XDH (0.31)
SCHEMBL8991134 0.78 GAA (0.42) EGFRSRC
SCHEMBL8990963 0.78 MEN1 (0.48) EGFRSRC
SCHEMBL8991320 0.77 ALDH1A1 (0.47)
SCHEMBL8991084 0.77 LRRK2 (0.42) YTHDC1EGFRSRC

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