SCHEMBL16951529

SCHEMBL16951529

[CH2]C(CO)c1cccc(OC(F)F)c1C=C

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DRD1 P21728 1/20 0.33
▸ MEN1 O00255 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ TSHR P16473 1/20 0.33
▸ RAB9A P51151 1/20 0.32
▸ NR3C1 P04150 1/20 0.30
▸ PGR P06401 1/20 0.30
▸ AR P10275 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ HPGD P15428 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
SCHEMBL16960306 0.85 IRAK4 (0.33) MEN1KMT2ALMNA
SCHEMBL16961603 0.82 ALOX15 (0.38) MEN1KMT2ALMNA
SCHEMBL16954159 0.82 LMNA (0.41) MEN1KMT2ALMNAHPGD
SCHEMBL16955429 0.81 DRD1 (0.33) DRD1MEN1KMT2ATSHR
SCHEMBL16952066 0.81 KCNK3 (0.34) —
SCHEMBL16951492 0.80 MEN1 (0.36) DRD1MEN1KMT2ATSHRRAB9A
SCHEMBL16950475 0.80 KMT2A (0.34) DRD1MEN1KMT2ATSHRRAB9A
SCHEMBL16961269 0.79 MEN1 (0.35) DRD1MEN1KMT2ATSHRRAB9A
SCHEMBL16953280 0.79 KMT2A (0.35) DRD1MEN1KMT2ATSHRRAB9A
SCHEMBL16956824 0.79 ALDH1A1 (0.39) DRD1MEN1KMT2ATSHRRAB9A

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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