SCHEMBL670603

SCHEMBL670603

CCCCCC(CC)OC(=O)C(=Cc1ccccc1)OC.CCCCCC(CC)OC(=O)c1ccccc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
ALDH1A1 P00352 5/20 0.42
TSHR P16473 2/20 0.39
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 1/20 0.38
CTSK P43235 2/20 0.37
CTSL P07711 1/20 0.37
CTSB P07858 1/20 0.37
NAAA Q02083 1/20 0.37
KDM4E B2RXH2 2/20 0.36
HPGD P15428 2/20 0.36
GAA P10253 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
SLC37A4 O43826 1/20 0.36
PRKCA P17252 1/20 0.35
PRKCD Q05655 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HSD17B10 Q99714 1/20 0.34

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
SCHEMBL28438244 0.92 ALDH1A1 (0.46) LMNAALDH1A1TSHRPRSS1PRSS2
SCHEMBL62157 0.89 CTSK (0.44) LMNAALDH1A1CTSKCTSLCTSB
SCHEMBL14698302 0.89 CTSK (0.44) LMNAALDH1A1CTSKCTSLCTSB
SCHEMBL19717782 0.86 CTSK (0.42) LMNAALDH1A1CTSKCTSLCTSB
Glycine SCHEMBL4305400 0.84 CTSK (0.40) LMNAALDH1A1CTSKCTSLCTSB
SCHEMBL28030230 0.84 LMNA (0.58) LMNAALDH1A1TSHRPRSS1PRSS2
SCHEMBL63237 0.84 LMNA (0.58) LMNAALDH1A1TSHRPRSS1PRSS2
Stearic Acid SCHEMBL15049028 0.83 TDP1 (0.43) LMNAALDH1A1CTSKCTSLCTSB
Cinnamic Acid SCHEMBL14166230 0.83 EGFR (0.44) LMNAALDH1A1CTSKCTSLCTSB
SCHEMBL17907462 0.82 LMNA (0.56) LMNAALDH1A1TSHRPRSS1PRSS2

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
WO-2012023116-A1 COSMETIC METHOD L'OREAL (FR) 2012-02-23 WO disclosed