SCHEMBL16958366

SCHEMBL16958366

C=Cc1cccc(CC)c1OC(F)(F)F

nearest known ligand 0.37

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GABRA1 P14867 2/20 0.37
▸ GABRB2 P47870 2/20 0.37
▸ LMNA P02545 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ PDK2 Q15119 1/20 0.31
▸ CHRM2 P08172 1/20 0.31
▸ CHRM1 P11229 1/20 0.31
▸ CHRM3 P20309 1/20 0.31
▸ SLC6A4 P31645 2/20 0.31
▸ SLC6A2 P23975 1/20 0.31
▸ SLC6A3 Q01959 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
SCHEMBL16954578 0.88 CTSS (0.31) —
SCHEMBL16955331 0.85 GABRA1 (0.42) GABRA1GABRB2LMNASMN1; SMN2PDK2
SCHEMBL16955872 0.84 SIRT2 (0.36) PDK2
SCHEMBL16962157 0.82 ALDH1A1 (0.37) —
SCHEMBL14999526 0.80 CA1 (0.41) GABRA1GABRB2LMNA
SCHEMBL16958235 0.78 L3MBTL1 (0.37) LMNASMN1; SMN2PDK2CHRM2CHRM1
SCHEMBL16950503 0.78 L3MBTL1 (0.40) GABRA1GABRB2SMN1; SMN2
SCHEMBL16951326 0.78 GABRA1 (0.41) GABRA1GABRB2PDK2CHRM2CHRM1
SCHEMBL16952711 0.78 SCN8A (0.37) LMNASLC6A4
SCHEMBL16956059 0.77 GABRA1 (0.34) GABRA1GABRB2

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-2900645-A1 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION Bayer CropScience AG (DE) 2015-08-05 — — EP disclosed
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