SCHEMBL21610495

SCHEMBL21610495

CC[S+]([O-])c1c(-c2nc3cc(C(F)(F)C(F)(F)F)cnc3n2C)nc(-c2cccc(C3(C#N)CC3)c2)n1C

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.31

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
SCHEMBL21610526 0.92 CYP1A2 (0.31) —
SCHEMBL21610557 0.89 POLB (0.33) SIGMAR1
SCHEMBL21610491 0.88 — —
SCHEMBL21610537 0.87 POLB (0.35) —
SCHEMBL23353553 0.86 PIK3CD (0.33) PIK3CD
SCHEMBL21610560 0.85 POLB (0.31) —
SCHEMBL21610554 0.83 POLB (0.37) SIGMAR1
SCHEMBL23351441 0.80 POLB (0.36) PIK3CDSIGMAR1
SCHEMBL21610498 0.79 POLB (0.35) —
SCHEMBL21610489 0.78 DGAT1 (0.34) PIK3CD

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
WO-2020002082-A1 HETEROCYCLENE DERIVATIVES AS PEST CONTROL AGENTS BAYER AKTIENGESELLSCHAFT (DE) 2020-01-02 — — WO disclosed
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