SCHEMBL16955698

SCHEMBL16955698

CCOc1c([CH]O)cccc1OC(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3A P49840 1/20 0.38
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 2/20 0.35
▸ ATM Q13315 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ MEN1 O00255 4/20 0.33
▸ KMT2A Q03164 4/20 0.33
▸ NPC1 O15118 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ IGF1R P08069 1/20 0.33
▸ AGTR1 P30556 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ RAB9A P51151 2/20 0.33

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
SCHEMBL16953545 0.88 GSK3A (0.38) GSK3AMAPTATML3MBTL1MEN1
SCHEMBL16960196 0.85 MEN1 (0.42) GSK3AMAPTLMNAATMSMN1; SMN2
SCHEMBL16953072 0.82 GSK3A (0.52) GSK3AMAPTLMNAATMSMN1; SMN2
SCHEMBL16957104 0.82 NFE2L2 (0.45) MAPTLMNAKDM4EHPGDHSD17B10
SCHEMBL16952225 0.81 NFE2L2 (0.33) LMNAL3MBTL1ALDH1A1GAA
SCHEMBL16950721 0.79 PTGES (0.41) GSK3AMAPTLMNAATMSMN1; SMN2
SCHEMBL16955079 0.79 GSK3A (0.36) GSK3AMAPTLMNAATMSMN1; SMN2
SCHEMBL16955265 0.78 GSK3A (0.38) GSK3AMAPTLMNAATMMEN1
SCHEMBL16954498 0.78 PDK2 (0.40) MAPTLMNAATMSMN1; SMN2L3MBTL1
SCHEMBL16952532 0.78 KCNH2 (0.33) KDM4EFBP1

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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