SCHEMBL16518643

SCHEMBL16518643

CCCC[C@]1(C)CCc2cc(OC)cc(C)c2O1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.55
PPARG P37231 3/20 0.55
AKT1 P31749 10/20 0.52
LMNA P02545 1/20 0.48
NR1I2 O75469 2/20 0.47
ALOX5 P09917 3/20 0.44
PDPK1 O15530 3/20 0.44
PHLPP1 O60346 3/20 0.44
ILK Q13418 3/20 0.44

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
SCHEMBL2620996 0.83 LMNA (0.73) PPARAPPARGAKT1LMNANR1I2
SCHEMBL16562601 0.78 ALOX5 (0.77) PPARAPPARGAKT1LMNANR1I2
SCHEMBL16077002 0.76 PPARA (0.81) PPARAPPARGNR1I2ALOX5
SCHEMBL5838865 0.75 AKT1 (0.73) AKT1LMNANR1I2ALOX5PDPK1
SCHEMBL5839319 0.75 AKT1 (0.73) AKT1LMNANR1I2ALOX5PDPK1
SCHEMBL15452009 0.73 AKT1 (0.78) AKT1LMNANR1I2ALOX5PDPK1
SCHEMBL25060005 0.72 PPARA (1.00) PPARAPPARGNR1I2ALOX5
SCHEMBL16562606 0.72 PPARA (1.00) PPARAPPARGNR1I2ALOX5
SCHEMBL14273394 0.71 LMNA (0.62) AKT1LMNANR1I2ALOX5PDPK1
SCHEMBL21226798 0.71 AKT1 (0.62) PPARAPPARGAKT1LMNANR1I2

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
US-8961944-B2 Use of delta-tocopheryl-carbohydrate as a depigmenting agent PIERRE FABRE DERMO-COSMETIQUE (FR) 2015-02-24 US disclosed