SCHEMBL23222167

SCHEMBL23222167

CC[S+]([O-])c1c(-c2nc3cc(C(F)(F)F)cnc3n2C)ncc2sccc12

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.39
▸ SCN9A Q15858 1/20 0.30
▸ KDM4E B2RXH2 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
SCHEMBL23222170 0.87 POLB (0.39) POLB
SCHEMBL23222089 0.83 — —
SCHEMBL19806269 0.82 POLB (0.39) POLB
SCHEMBL19806351 0.80 POLB (0.41) POLBSCN9AKDM4E
SCHEMBL16594157 0.80 POLB (0.42) POLBKDM4E
SCHEMBL23956596 0.78 POLB (0.39) POLBKDM4E
SCHEMBL15868304 0.77 POLB (0.42) POLB
SCHEMBL23934201 0.77 POLB (0.42) POLB
SCHEMBL16612441 0.76 POLB (0.44) POLB
SCHEMBL14684622 0.76 POLB (0.42) POLBKDM4E

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
EP-3487860-B1 CONDENSED BICYCLIC HETEROCYCLIC DERIVATIVES AS PESTICIDES BAYER CROPSCIENCE AG (DE) 2021-04-14 — — EP disclosed
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