SCHEMBL27284643

SCHEMBL27284643

C=CCCC(CCC)c1c(C)ccnc1N

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NOS2 P35228 5/20 0.42
NOS3 P29474 4/20 0.41
NOS1 P29475 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
SCHEMBL19779562 0.67 NOS2 (0.44) NOS2NOS3NOS1
SCHEMBL25762405 0.66 NOS2 (0.56) NOS2NOS3NOS1
SCHEMBL23977203 0.66
SCHEMBL12439413 0.65 NOS2 (0.54) NOS2NOS3NOS1
SCHEMBL4635860 0.64 AOC3 (0.39)
SCHEMBL27437861 0.64 NOS2 (0.33) NOS2NOS3
SCHEMBL23987331 0.63
SCHEMBL12165869 0.63 ESR1 (0.38)
SCHEMBL21883625 0.61 NOS2 (0.34) NOS2NOS3
SCHEMBL30154750 0.60 NOS2 (1.00) NOS2NOS3NOS1

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
WO-2024134515-A1 NOVEL COMPOUND AS RON INHIBITOR 주식회사 엘지화학 2024-06-27 WO disclosed