SCHEMBL16953202

SCHEMBL16953202

[CH2]C(CO)c1cc(Br)ccc1C1CC1

nearest known ligand 0.34

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PTGDR Q13258 1/20 0.34
▸ PTGDR2 Q9Y5Y4 1/20 0.34

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
SCHEMBL16955310 0.82 ESR2 (0.35) —
SCHEMBL16952051 0.81 PTGDR2 (0.34) PTGDR2
SCHEMBL16959880 0.81 OPRL1 (0.36) PTGDR2
SCHEMBL16958930 0.81 TAAR1 (0.35) PTGDRPTGDR2
SCHEMBL16954594 0.80 CHRNA1 (0.38) PTGDR2
SCHEMBL16957291 0.78 MBTD1 (0.33) PTGDRPTGDR2
SCHEMBL16955738 0.77 — —
SCHEMBL16955251 0.77 PTGDR2 (0.39) PTGDR2
SCHEMBL16952967 0.77 KDM1A (0.33) PTGDRPTGDR2
SCHEMBL16952558 0.76 CHRNB2 (0.39) —

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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