SCHEMBL16950475

SCHEMBL16950475

[CH2]C(CO)c1cccc(OC(F)F)c1F

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 0.34
▸ HTT P42858 2/20 0.33
▸ POLB P06746 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ SLC6A2 P23975 1/20 0.33
▸ SLC6A4 P31645 1/20 0.33
▸ KCNH2 Q12809 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ MEN1 O00255 3/20 0.32
▸ TSHR P16473 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ GABRA1 P14867 1/20 0.31
▸ GABRG2 P18507 1/20 0.31
▸ GABRB3 P28472 1/20 0.31
▸ ALOX12 P18054 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
SCHEMBL16958582 0.86 IRAK4 (0.35) KMT2APOLBMEN1ALDH1A1GABRA1
SCHEMBL16956824 0.83 ALDH1A1 (0.39) KMT2AHTTPOLBSMN1; SMN2DRD1
SCHEMBL16953280 0.83 KMT2A (0.35) KMT2AHTTPOLBSMN1; SMN2DRD1
SCHEMBL16955100 0.82 POLB (0.40) HTTPOLBSMN1; SMN2TSHRALDH1A1
SCHEMBL16958070 0.81 ALDH1A1 (0.41) ALDH1A1
SCHEMBL16961269 0.80 MEN1 (0.35) KMT2AHTTSLC6A2SLC6A4KCNH2
SCHEMBL16951529 0.80 DRD1 (0.33) KMT2ADRD1MEN1TSHRRAB9A
SCHEMBL16953507 0.79 MPL (0.37) SLC6A2SLC6A4KCNH2
SCHEMBL16961924 0.78 KMT2A (0.38) KMT2AHTTPOLBSMN1; SMN2SLC6A2
SCHEMBL16961608 0.77 HTT (0.33) KMT2AHTTSMN1; SMN2SLC6A2SLC6A4

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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