SCHEMBL29683533

SCHEMBL29683533

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)F)ncc3n2C)nc2n1CCCC2O

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ NR1H2 P55055 18/20 0.35
▸ NR1H3 Q13133 12/20 0.35
▸ RORC P51449 2/20 0.33

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
SCHEMBL19876682 1.00 NR1H2 (0.35) NR1H2NR1H3RORC
SCHEMBL19876674 0.90 NR1H2 (0.32) NR1H2NR1H3RORC
SCHEMBL19888424 0.90 NR1H2 (0.32) NR1H2NR1H3RORC
SCHEMBL29683582 0.90 NR1H2 (0.32) NR1H2NR1H3RORC
SCHEMBL19888443 0.90 NR1H2 (0.32) NR1H2NR1H3RORC
SCHEMBL19888466 0.90 NR1H2 (0.32) NR1H2NR1H3RORC
SCHEMBL19888442 0.89 NR1H2 (0.31) NR1H2NR1H3RORC
SCHEMBL20386958 0.84 CNR2 (0.36) NR1H2NR1H3RORC
SCHEMBL19174367 0.83 MEN1 (0.34) RORC
SCHEMBL20386811 0.83 CNR2 (0.40) RORC

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
EP-3497102-B1 CONDENSED BICYCLIC HETEROCYCLE DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2022-12-07 — — EP disclosed
CN-109996799-B Fused bicyclic heterocyclic derivatives as pest control agents 拜耳作物科学股份公司 2022-07-19 — — CN disclosed
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