SCHEMBL31141508

SCHEMBL31141508

CCS(=O)(=O)c1ccc(C(=O)NC)nc1-c1nc2cc(C(F)(F)F)cnc2n1C

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.44
▸ SCN9A Q15858 10/20 0.42
▸ DDR1 Q08345 4/20 0.37
▸ PKM P14618 1/20 0.36
▸ SCN7A Q01118 1/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ SCN5A Q14524 1/20 0.35
▸ RORC P51449 2/20 0.35
▸ SCN10A Q9Y5Y9 3/20 0.35
▸ RAF1 P04049 1/20 0.34
▸ BRAF P15056 1/20 0.34

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
SCHEMBL18506241 1.00 POLB (0.44) POLBSCN9ADDR1PKMSCN7A
SCHEMBL18498634 0.89 POLB (0.46) POLBSCN9ADDR1SCN7AKCNH2
SCHEMBL31141500 0.89 POLB (0.46) POLBSCN9ADDR1SCN7AKCNH2
SCHEMBL23507301 0.85 POLB (0.45) POLBDDR1PKM
SCHEMBL18498639 0.84 DDR1 (0.39) SCN9ADDR1RORC
SCHEMBL18498763 0.84 POLB (0.45) POLBDDR1
SCHEMBL18498702 0.84 POLB (0.44) POLBDDR1RORCSCN10ABRAF
SCHEMBL17844037 0.83 POLB (0.44) POLBDDR1PKM
SCHEMBL18498665 0.83 POLB (0.44) POLBDDR1KCNH2
SCHEMBL18506250 0.82 POLB (0.43) POLBSCN9APKMSCN10ARAF1

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
CN-118955472-A 2- (Hetero) aryl substituted fused heterocyclic derivatives as pesticides 拜耳作物科学股份公司 2024-11-15 — — CN disclosed
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