SCHEMBL30299485

SCHEMBL30299485

O=C(Nc1ccc(F)cc1)C1=C(O)CC(c2ccc(C(F)(F)F)nc2)NC1=O

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.44
KCNH2 Q12809 1/20 0.44
TAAR1 Q96RJ0 1/20 0.44
ROCK1 Q13464 1/20 0.40
HDAC4 P56524 1/20 0.38
DGAT1 O75907 1/20 0.38
EGLN2 Q96KS0 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
EGLN3 Q9H6Z9 1/20 0.38

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
SCHEMBL24168453 1.00 SLC6A3 (0.44) SLC6A3KCNH2TAAR1ROCK1HDAC4
SCHEMBL25253776 0.90 SLC6A3 (0.43) SLC6A3KCNH2TAAR1ROCK1HDAC4
SCHEMBL30520430 0.90 SLC6A3 (0.43) SLC6A3KCNH2TAAR1ROCK1HDAC4
SCHEMBL26313815 0.89 SLC6A3 (0.43) SLC6A3KCNH2TAAR1ROCK1HDAC4
SCHEMBL24168239 0.89 SLC6A3 (0.38) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL25251833 0.88 SLC6A3 (0.42) SLC6A3KCNH2TAAR1ROCK1HDAC4
SCHEMBL30520197 0.88 SLC6A3 (0.42) SLC6A3KCNH2TAAR1ROCK1HDAC4
SCHEMBL25253944 0.87 SLC6A3 (0.41) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL25796436 0.86 SLC6A3 (0.40) SLC6A3KCNH2TAAR1ROCK1
SCHEMBL31186087 0.81 SLC6A3 (0.40) SLC6A3KCNH2TAAR1ROCK1HDAC4

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-118696031-A Aryltetrahydropyridine derivative or salt thereof, pest control agent containing the same, and method for using the same 日本农药株式会社 2024-09-24 CN disclosed
CN-115916752-A Aryltetrahydropyridine derivatives or salts thereof, and pesticides containing the same and methods of use thereof 日本农药株式会社 2023-04-04 CN disclosed