SCHEMBL16960099

SCHEMBL16960099

C=Cc1cccc(OC(F)F)c1CC

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.36
▸ HPGD P15428 3/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ MAPT P10636 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ POLB P06746 1/20 0.33
▸ DRD1 P21728 1/20 0.33
▸ MEN1 O00255 3/20 0.32
▸ KMT2A Q03164 3/20 0.32
▸ SLC6A2 P23975 1/20 0.32
▸ SLC6A4 P31645 1/20 0.32
▸ KCNH2 Q12809 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ GAA P10253 1/20 0.32
▸ RAB9A P51151 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.31
▸ PTGES2 Q9H7Z7 1/20 0.30
▸ NPC1 O15118 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
SCHEMBL16953287 0.85 MCHR1 (0.34) LMNAL3MBTL1MAPTSMN1; SMN2KDM4E
SCHEMBL16959656 0.84 LMNA (0.39) LMNAHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL16961953 0.80 L3MBTL1 (0.38) LMNAHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL9310748 0.80 TLR2 (0.41) LMNAMAPTSMN1; SMN2KDM4EPOLB
SCHEMBL16952603 0.78 MEN1 (0.40) LMNAHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL16951576 0.78 MEN1 (0.33) LMNAHPGDDRD1MEN1KMT2A
SCHEMBL9310614 0.78 ALDH1A1 (0.40) LMNAHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL16954898 0.78 L3MBTL1 (0.38) LMNAHPGDL3MBTL1MAPTSMN1; SMN2
SCHEMBL16955538 0.78 KMT2A (0.34) LMNAHPGDMAPTSMN1; SMN2HTT
SCHEMBL16954090 0.77 F2R (0.32) KDM4ESLC6A2SLC6A4GAAPTGES2

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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