SCHEMBL8445260

SCHEMBL8445260

CCCCCCOC(=O)C=Cc1ccc(O)c(OC)c1CC

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
APP P05067 8/20 0.57
AKR1B10 O60218 4/20 0.44
AKR1B1 P15121 4/20 0.44
HCAR2 Q8TDS4 2/20 0.44
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MET P08581 1/20 0.42

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
SCHEMBL27707848 0.87 APP (0.60) APPHCAR2
SCHEMBL17459717 0.86 ESR1 (0.49) APP
SCHEMBL27728337 0.82 ALOX5 (0.52) APPAKR1B10AKR1B1KDM4EALDH1A1
SCHEMBL19358965 0.80 APP (0.64) APPHCAR2
SCHEMBL19358963 0.80 APP (0.64) APPHCAR2
SCHEMBL1405663 0.79 KDM4E (0.46) APPKDM4EALDH1A1
SCHEMBL27861984 0.78 ALOX5 (0.48)
SCHEMBL1259776 0.77 PTPN1 (0.42) APPKDM4EALDH1A1
SCHEMBL27983290 0.77 ALOX5 (0.47)
SCHEMBL19358961 0.77 APP (0.63) APPAKR1B10AKR1B1HCAR2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016012797-A1 ANTI-DANDRUFF COMPOSITION CRODA INTERNATIONAL PLC (GB) 2016-01-28 WO disclosed
US-5908615-A Ferulic acid ester antioxidant/UV absorbent TSUNO FOOD INDUSTRIAL CO., LTD. (JP) 1999-06-01 US disclosed