SCHEMBL29599154

SCHEMBL29599154

CCS(=O)(=O)c1c(-c2nc3cc(C(F)(F)F)ncc3n2C)sc2c(C#N)csc12

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 2/20 0.33
▸ SCN9A Q15858 3/20 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
SCHEMBL21875185 1.00 S1PR1 (0.33) S1PR1SCN9A
SCHEMBL21949317 0.88 KCNH2 (0.32) —
SCHEMBL29581433 0.88 KCNH2 (0.33) —
SCHEMBL20547491 0.88 KCNH2 (0.33) —
SCHEMBL21948581 0.87 KCNH2 (0.31) —
SCHEMBL24361053 0.85 KCNH2 (0.30) —
SCHEMBL21875156 0.84 KCNH2 (0.33) S1PR1
SCHEMBL21875169 0.84 KCNH2 (0.31) —
SCHEMBL21948704 0.84 RORC (0.32) —
SCHEMBL29599914 0.84 KCNH2 (0.33) S1PR1

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-110582503-B Fused bicyclic heterocyclic compound derivatives as pest control agents 拜耳公司 2022-05-31 — — CN disclosed
Send feedback