SCHEMBL16955715

SCHEMBL16955715

[CH2]C(CF)c1cc(Br)ccc1Br

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.34
▸ TLR9 Q9NR96 1/20 0.34
▸ ALOX15 P16050 1/20 0.31
▸ PTPRC P08575 1/20 0.31
▸ S100A4 P26447 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ L3MBTL1 Q9Y468 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
SCHEMBL16958288 0.82 DPP4 (0.33) —
SCHEMBL16957412 0.82 PKM (0.31) —
SCHEMBL16953554 0.81 CYP1A2 (0.33) ALDH1A1TDP1L3MBTL1
SCHEMBL16953786 0.81 MAPT (0.31) —
SCHEMBL16952559 0.81 — —
SCHEMBL16956011 0.81 CA1 (0.33) —
SCHEMBL16960609 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL16954337 0.80 MEN1 (0.32) —
SCHEMBL16955888 0.80 ALOX15 (0.35) HSP90AA1TLR9ALOX15PTPRCS100A4
SCHEMBL16959300 0.78 MAOB (0.38) —

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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