SCHEMBL16959566

SCHEMBL16959566

CCCCc1cccc([C](C)CO)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 3/20 0.48
▸ CYP4A11 Q02928 3/20 0.48
▸ LPL P06858 3/20 0.46
▸ LIPG Q9Y5X9 3/20 0.46
▸ PPARG P37231 1/20 0.43
▸ PPARA Q07869 1/20 0.43
▸ NPC1 O15118 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ XIAP P98170 1/20 0.40
▸ SPHK2 Q9NRA0 1/20 0.40
▸ SPHK1 Q9NYA1 1/20 0.40
▸ MAP1LC3B Q9GZQ8 1/20 0.39
▸ MAP1LC3A Q9H492 1/20 0.39

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
SCHEMBL16951049 0.89 CYP4F2 (0.44) CYP4F2CYP4A11LPLLIPGMAP1LC3B
SCHEMBL16954812 0.85 CYP4F2 (0.47) CYP4F2CYP4A11LPLLIPGPPARG
SCHEMBL16951379 0.84 LPL (0.50) CYP4F2CYP4A11LPLLIPGPPARG
SCHEMBL16953885 0.82 CYP4F2 (0.42) CYP4F2CYP4A11
SCHEMBL16958374 0.82 HPGD (0.47) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL12802707 0.81 LPL (0.47) CYP4F2CYP4A11LPLLIPGPPARG
SCHEMBL8341269 0.81 CYP4F2 (0.53) CYP4F2CYP4A11LPLLIPGPPARG
SCHEMBL16952321 0.80 PRSS1 (0.55) CYP4F2CYP4A11NPC1HTTRAB9A
SCHEMBL27875968 0.79 LPL (0.46) CYP4F2CYP4A11LPLLIPGPPARG
SCHEMBL16961454 0.79 HPGD (0.44) NPC1HPGDMAPK1HTTRAB9A

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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