SCHEMBL21021072

SCHEMBL21021072

CC(=O)C1C(c2cc(C)cc(C(C)(C)F)c2)C1(C)Cl

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31
SLC9A1 P19634 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL21020569 0.80 GAA (0.34) SLC9A1SMN1; SMN2
SCHEMBL23466013 0.70 FFAR4 (0.40) PGK1PGK2
SCHEMBL25870304 0.70 FFAR4 (0.40) PGK1PGK2
SCHEMBL21020525 0.68 CES2 (0.34)
SCHEMBL25870323 0.68 MEN1 (0.36) SMN1; SMN2
SCHEMBL21021071 0.67
SCHEMBL20076824 0.67 SLC9A1 (0.38) SLC9A1SMN1; SMN2
SCHEMBL25870348 0.66 GPR35 (0.39) SMN1; SMN2
SCHEMBL20076696 0.65 GAA (0.44) SLC9A1SMN1; SMN2
SCHEMBL21021136 0.65 SLC9A1 (0.38) SLC9A1

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-3283459-B1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO DOW AGROSCIENCES LLC (US) 2019-05-22 EP disclosed