SCHEMBL1827105

SCHEMBL1827105

Cc1c(CCCCO)cccc1CCCCO

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 1/20 0.39
CD274 Q9NZQ7 1/20 0.39
CYP4F2 P78329 4/20 0.39
CYP4A11 Q02928 4/20 0.39
LIPG Q9Y5X9 1/20 0.38
ALOX5 P09917 1/20 0.38
PTGS2 P35354 1/20 0.38
TYR P14679 1/20 0.36
BID P55957 3/20 0.36
MCL1 Q07820 3/20 0.36
BCL2L1 Q07817 2/20 0.36
BAK1 Q16611 2/20 0.36
KAT8 Q9H7Z6 2/20 0.36
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
EP300 Q09472 1/20 0.36
KAT2A Q92830 1/20 0.36
KAT2B Q92831 1/20 0.36
KAT5 Q92993 1/20 0.36
SAE1 Q9UBE0 1/20 0.36

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
SCHEMBL1322332 0.90 ESR1 (0.42) PDCD1CD274CYP4F2CYP4A11LIPG
SCHEMBL28533080 0.88 ESR1 (0.41) PDCD1CD274LIPGTYRBID
SCHEMBL11286658 0.88 ESR1 (0.41) PDCD1CD274LIPGTYRBID
SCHEMBL26637365 0.86 TAAR1 (0.35) PDCD1CD274CYP4F2CYP4A11LIPG
SCHEMBL13504548 0.84 KDM4E (0.36) CYP4F2CYP4A11LIPGALOX5PTGS2
SCHEMBL5694414 0.83 PDCD1 (0.43) PDCD1CD274CYP4F2CYP4A11GABRA1
SCHEMBL19644227 0.83 CD274 (0.66) PDCD1CD274
SCHEMBL79526 0.83 ESR1 (0.43) PDCD1CD274CYP4F2CYP4A11KDM4E
SCHEMBL28091513 0.81 TRPA1 (0.45) PDCD1CD274TYRBIDMCL1
SCHEMBL9672220 0.80 LIPG (0.43) CYP4F2CYP4A11LIPGBIDMCL1

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
CN-106726659-B High-oil-content cationic gel system and preparation method thereof 广州市科能化妆品科研有限公司 2020-06-02 CN disclosed
EP-2319484-A2 Water-in-oil emulsion system and preparation process thereof Evonik Goldschmidt GmbH (DE) 2011-05-11 EP disclosed