SCHEMBL16958137

SCHEMBL16958137

O[CH]c1cc(F)ccc1OC(F)F

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ HTT P42858 4/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.38
▸ KMT2A Q03164 5/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ HPGD P15428 2/20 0.36
▸ PDE4B Q07343 2/20 0.35
▸ GLA P06280 1/20 0.34
▸ HCRTR1 O43613 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ LMNA P02545 2/20 0.34
▸ PDE4A P27815 1/20 0.34
▸ PDE4C Q08493 1/20 0.34
▸ PDE4D Q08499 1/20 0.34
▸ CA12 O43570 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34

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
SCHEMBL16951942 0.84 ALDH1A1 (0.46) MAPTALDH1A1HTTSMN1; SMN2POLB
SCHEMBL31006009 0.81 DRD1 (0.42) MAPTALDH1A1HTTSMN1; SMN2POLB
SCHEMBL16793397 0.81 DRD1 (0.42) MAPTALDH1A1HTTSMN1; SMN2POLB
SCHEMBL16952820 0.81 MAPT (0.38) MAPTALDH1A1HTTSMN1; SMN2POLB
SCHEMBL16959583 0.80 ALDH1A1 (0.43) MAPTALDH1A1HTTSMN1; SMN2POLB
SCHEMBL16951223 0.80 ALDH1A1 (0.48) MAPTALDH1A1HTTSMN1; SMN2POLB
SCHEMBL16954082 0.80 TSHR (0.41) MAPTALDH1A1HTTPOLBL3MBTL1
SCHEMBL16957792 0.77 MAPT (0.44) MAPTALDH1A1SMN1; SMN2POLBKMT2A
SCHEMBL16952358 0.77 PDE4B (0.39) PDE4B
SCHEMBL16955823 0.77 NFE2L2 (0.47) HTTLMNACA12CA1CA2

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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