SCHEMBL16959744

SCHEMBL16959744

C[C](C)c1cc(OCC(C)C)cc(C(C)(C)C)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ HPGD P15428 2/20 0.35
▸ XBP1 P17861 1/20 0.35
▸ KAT6A Q92794 2/20 0.34
▸ NR1H4 Q96RI1 3/20 0.34
▸ SCN9A Q15858 3/20 0.33
▸ RARA P10276 1/20 0.33
▸ RARB P10826 1/20 0.33
▸ RARG P13631 1/20 0.33
▸ GCK P35557 1/20 0.33
▸ PDK2 Q15119 1/20 0.33
▸ F2R P25116 2/20 0.32
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ FOS P01100 1/20 0.32
▸ JUN P05412 1/20 0.32
▸ ACACB O00763 2/20 0.31
▸ NR4A1 P22736 1/20 0.31
▸ NR4A2 P43354 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
SCHEMBL16957459 0.86 KAT6A (0.33) POLBMAPTHPGDXBP1KAT6A
SCHEMBL16954802 0.86 SCN9A (0.46) POLBMAPTHPGDXBP1KAT6A
SCHEMBL16950625 0.84 LMNA (0.32) POLBMAPTHPGDXBP1KAT6A
SCHEMBL16959409 0.81 EPHX2 (0.39) NR1H4F2RNR4A1NR4A2NR4A3
SCHEMBL16955748 0.78 HPGD (0.43) POLBMAPTHPGDXBP1NR1H4
SCHEMBL16959501 0.78 MEN1 (0.39) POLBMAPTHPGDXBP1KAT6A
SCHEMBL16958080 0.78 POLB (0.37) POLBMAPTHPGDXBP1KAT6A
SCHEMBL16956273 0.77 PLA2G2A (0.44) MAPT
SCHEMBL16950724 0.77 FFAR4 (0.41) POLBMAPTHPGDXBP1KAT6A
SCHEMBL16958541 0.77 HPGD (0.40) POLBMAPTHPGDXBP1KAT6A

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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