SCHEMBL28901984

SCHEMBL28901984

NC(=O)c1cccc2c1nc(CCc1ccccc1)n2Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.52
▸ PPARG P37231 9/20 0.50
▸ TLR7 Q9NYK1 2/20 0.45
▸ HDAC1 Q13547 2/20 0.44
▸ HDAC8 Q9BY41 1/20 0.44
▸ POLB P06746 1/20 0.44

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
SCHEMBL29412023 1.00 PARP1 (0.52) PARP1PPARGTLR7HDAC1HDAC8
SCHEMBL29412078 0.89 LMNA (0.55) PARP1PPARG
SCHEMBL28487665 0.81 PKN1 (0.56) PARP1HDAC1HDAC8
SCHEMBL29412017 0.81 PKN1 (0.56) PARP1HDAC1HDAC8
SCHEMBL28478408 0.77 ALDH1A1 (0.58) PARP1PPARG
SCHEMBL29412060 0.77 PKN1 (0.54) PARP1PPARG
SCHEMBL28494472 0.77 PARP1 (0.49) PARP1PPARGPOLB
SCHEMBL28479697 0.77 PPARG (0.50) PARP1PPARG
SCHEMBL29411973 0.77 PPARG (0.50) PARP1PPARG
SCHEMBL6953212 0.77 PPARG (0.50) PARP1PPARG

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 2 patents. 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
CN-111978301-A Benzimidazole compound with endothelial lipase inhibition effect and application thereof 盐城师范学院 2020-11-24 — — CN disclosed
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