SCHEMBL28290935

SCHEMBL28290935

[CH2]c1cc(C#N)c2csccc1-2

nearest known ligand 0.34

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LRRK2 Q5S007 1/20 0.34
ADORA2A P29274 1/20 0.30
ADORA1 P30542 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
SCHEMBL19459387 0.69 ESR1 (0.39)
SCHEMBL131540 0.63
SCHEMBL28984283 0.61 KCNH2 (0.48) LRRK2
SCHEMBL10629429 0.61 ESR2 (0.52) LRRK2ADORA2AADORA1
SCHEMBL27174234 0.60 CYP2A6 (0.36)
SCHEMBL154729 0.60
SCHEMBL11937865 0.59 LRRK2 (0.51) LRRK2ADORA2AADORA1
SCHEMBL6771411 0.58 KCNH2 (0.62) LRRK2ADORA2AADORA1
SCHEMBL9359308 0.58 LRRK2 (0.43) LRRK2ADORA2AADORA1
SCHEMBL444735 0.58

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-106659161-B Amide compound and its harmful arthropod prevent and kill off purposes 住友化学株式会社 2019-08-02 CN disclosed
CN-106572659-B Harmful arthropod agent for preventing and eliminating containing amide compound 住友化学株式会社 2019-05-10 CN disclosed