SCHEMBL28575202

SCHEMBL28575202

CCCCC(c1nc(N)nc(N)n1)n1cc(C)nc1CC

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.32
HTR7 P34969 2/20 0.32
HTR6 P50406 2/20 0.32
HTR1A P08908 1/20 0.32
HTR2A P28223 1/20 0.32
DRD2 P14416 1/20 0.31

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
SCHEMBL28559978 0.96 TLR8 (0.31) TLR8
SCHEMBL28577388 0.95 TLR8 (0.31) TLR8
SCHEMBL28566419 0.92
SCHEMBL28559984 0.86 HRH4 (0.30)
SCHEMBL28566839 0.80 HTR1A (0.38) TLR8HTR7HTR6HTR1AHTR2A
SCHEMBL5604009 0.79 MAPT (0.33)
SCHEMBL28563239 0.76 TLR8 (0.40) TLR8HTR7HTR6HTR1AHTR2A
SCHEMBL28569887 0.75 DHFR (0.40) TLR8HTR7HTR6HTR1AHTR2A
SCHEMBL28564369 0.74 TSHR (0.40) TLR8HTR7HTR6HTR1AHTR2A
SCHEMBL28563228 0.71 HTR1A (0.36) TLR8HTR7HTR6HTR1AHTR2A

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
CN-112724596-A Curable composition and cured product 盛势达技研株式会社 2021-04-30 CN disclosed