SCHEMBL21268435

SCHEMBL21268435

COCCOc1cc[c]cc1OC(F)(F)F

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 2/20 0.34
ALDH1A1 P00352 2/20 0.34
HSD17B10 Q99714 1/20 0.34
KDM4E B2RXH2 3/20 0.34
HTT P42858 2/20 0.34
KMT2A Q03164 1/20 0.34
PIM1 P11309 1/20 0.33
CBFB Q13951 1/20 0.32
HPGD P15428 2/20 0.32
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
EGFR P00533 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
SCHEMBL17046285 0.86 MAPT (0.33) ALDH1A1HSD17B10KDM4EHTTKMT2A
SCHEMBL3082367 0.85 FDPS (0.33) ARALDH1A1HSD17B10KMT2AHPGD
SCHEMBL16957836 0.82 L3MBTL1 (0.35) ARALDH1A1KDM4EHPGDHCRTR1
SCHEMBL2094365 0.82 PLA2G2D (0.37) ALDH1A1KMT2APIM1HPGD
SCHEMBL182689 0.82 FDPS (0.39) ALDH1A1KMT2AHPGD
SCHEMBL4447536 0.80 L3MBTL1 (0.40) ARALDH1A1KDM4EKMT2A
SCHEMBL182573 0.80 CA12 (0.34)
SCHEMBL21268228 0.79 AR (0.43) ARALDH1A1HSD17B10KDM4EHTT
SCHEMBL28061577 0.79 DRD2 (0.32)
SCHEMBL621959 0.79 EPHX2 (0.33)

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-B1 HERBICIDAL AND FUNGICIDAL 3-PHENYLISOXAZOLIN DERIVATIVES BAYER CROPSCIENCE AG (DE) 2019-08-21 EP disclosed