SCHEMBL8991176

SCHEMBL8991176

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

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ XDH P47989 1/20 0.31
▸ PDE4A P27815 1/20 0.30
▸ PDE4B Q07343 1/20 0.30
▸ PDE4C Q08493 1/20 0.30
▸ PDE4D Q08499 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
SCHEMBL8991178 0.88 RET (0.31) —
SCHEMBL8991135 0.87 KDM4E (0.35) —
SCHEMBL8991361 0.80 MEN1 (0.46) PDE4APDE4BPDE4CPDE4D
SCHEMBL8991012 0.80 XDH (0.33) XDH
SCHEMBL8991288 0.78 MEN1 (0.40) PDE4APDE4BPDE4CPDE4D
SCHEMBL8991004 0.78 YTHDC1 (0.31) —
SCHEMBL8991163 0.78 YTHDC1 (0.31) —
SCHEMBL8991066 0.78 ALDH1A1 (0.44) —
SCHEMBL8990936 0.78 ADK (0.33) PDE4APDE4BPDE4CPDE4D
SCHEMBL8991300 0.77 PDE4A (0.43) PDE4APDE4BPDE4CPDE4D

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
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