SCHEMBL28049780

SCHEMBL28049780

N#CCOc1[c]ccc(CN)c1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LOXL2 Q9Y4K0 4/20 0.32
POLB P06746 1/20 0.31
LOX P28300 2/20 0.31
LOXL3 P58215 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
SCHEMBL12097644 0.76 ALOX5AP (0.33)
SCHEMBL22650 0.76 POLB (0.36) POLB
SCHEMBL23389 0.76 ALOX15 (0.33) POLB
SCHEMBL27792841 0.75 LOXL2 (0.39) LOXL2LOXLOXL3
SCHEMBL28049838 0.75 LOXL2 (0.37) LOXL2
SCHEMBL27947525 0.73 CA12 (0.33) LOXL2LOXLOXL3
SCHEMBL27869359 0.73 ALDH1A1 (0.37) LOXL2LOXLOXL3
SCHEMBL27660870 0.73 CSNK2A1 (0.41) LOXL2LOX
SCHEMBL28085689 0.73 MAOB (0.49) LOXL2
SCHEMBL28039906 0.73 LOXL2 (0.38) LOXL2LOXLOXL3

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103180317-B Heteroarylpiperidine and piperazine derivatives as fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-03-23 CN claimed
CN-105601627-B Heteroaryl piperidine and heteroaryl based piperazine derivative as fungicide 拜耳作物科学股份公司 2019-04-09 CN disclosed
CN-103180317-B Heteroarylpiperidine and piperazine derivatives as fungicides BAYER INTELLECTUAL PROPERTY GMBH (DE) 2016-03-23 CN disclosed