SCHEMBL21586924

SCHEMBL21586924

CCOC(OCC)[C@@H]1C(c2cc(Cl)cc(Cl)c2)C1(Cl)Cl

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 2/20 0.35
SLC6A4 P31645 2/20 0.35
SLC6A3 Q01959 1/20 0.35
SLC9A1 P19634 5/20 0.33

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
SCHEMBL18144218 1.00 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3SLC9A1
SCHEMBL18144215 1.00 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3SLC9A1
SCHEMBL18144212 1.00 SLC6A2 (0.35) SLC6A2SLC6A4SLC6A3SLC9A1
SCHEMBL18143869 0.86 KCNH2 (0.32) SLC6A2SLC6A4
SCHEMBL21587418 0.86 KCNH2 (0.32) SLC6A2SLC6A4
SCHEMBL18143872 0.86 KCNH2 (0.32) SLC6A2SLC6A4
SCHEMBL18143867 0.86 KCNH2 (0.32) SLC6A2SLC6A4
SCHEMBL31261400 0.86 KCNH2 (0.32) SLC6A2SLC6A4
SCHEMBL18146842 0.86 SLC9A1 (0.33) SLC9A1
SCHEMBL18146849 0.86 SLC9A1 (0.33) 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-3578543-A1 MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES, RELATED THERETO Dow AgroSciences LLC (US) 2019-12-11 EP disclosed