SCHEMBL29829696

SCHEMBL29829696

COc1cccc2c1nc(CCc1ccccc1)n2CCCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ TLR8 Q9NR97 1/20 0.51
▸ NPY1R P25929 3/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ CASR P41180 1/20 0.45
▸ PDE10A Q9Y233 1/20 0.44
▸ SIGMAR1 Q99720 2/20 0.44
▸ LMNA P02545 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ PKM P14618 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MAPT P10636 1/20 0.44
▸ BRD4 O60885 2/20 0.42
▸ CREBBP Q92793 2/20 0.42
▸ RECQL P46063 1/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ OPRM1 P35372 1/20 0.40
▸ EBP Q15125 1/20 0.40

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
SCHEMBL29829591 0.84 CASR (0.60) TLR8CASRSIGMAR1MEN1KMT2A
SCHEMBL29829518 0.81 CASR (0.60) TLR8CASRSIGMAR1LMNAMAPT
SCHEMBL29829544 0.81 CASR (0.49) TLR8NPY1RCASRPDE10ASIGMAR1
SCHEMBL29829974 0.80 CASR (0.53) TLR8L3MBTL1CASRSIGMAR1MAPT
SCHEMBL29412097 0.74 L3MBTL1 (0.50) L3MBTL1SIGMAR1LMNAMEN1PKM
SCHEMBL14685298 0.69 PDE10A (0.53) TLR8CASRPDE10AMEN1PKM
SCHEMBL7962010 0.69 NPY1R (0.77) NPY1R
SCHEMBL16512961 0.68 TLR8 (1.00) TLR8CASRMAPT
SCHEMBL29829733 0.68 TLR8 (0.48) TLR8NPY1RCASRMEN1KMT2A
SCHEMBL3882681 0.68 RAB9A (0.62) PDE10AMEN1PKMKMT2AMAPT

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-111978301-B Benzimidazole compound with endothelial lipase inhibition effect and application thereof 盐城师范学院 2022-08-02 — — CN disclosed
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