SCHEMBL29658140

SCHEMBL29658140

CCS(=O)(=O)c1c(-c2nc3cc(CC(F)(F)F)cnc3n2C)nc2cc(Cl)ccn12

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 1/20 0.31
POLB P06746 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
SCHEMBL21805959 0.89 POLB (0.40) POLB
SCHEMBL29458412 0.89 POLB (0.40) POLB
SCHEMBL29658126 0.88 FADS1 (0.33) POLB
SCHEMBL29658134 0.83 TRPA1 (0.36) POLB
SCHEMBL29658132 0.82 POLB (0.32) POLB
SCHEMBL19711919 0.81 POLB (0.42) POLB
SCHEMBL18737656 0.80 POLB (0.40) POLB
SCHEMBL18737470 0.79 POLB (0.40) POLB
SCHEMBL21561588 0.79 POLB (0.40) POLB
SCHEMBL21805955 0.78 POLB (0.41) POLB

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-3999505-A1 PESTICIDAL PYRAZOLE AND TRIAZOLE DERIVATIVES BASF SE (DE) 2022-05-25 EP disclosed