SCHEMBL7562610

SCHEMBL7562610

CCOC(=O)CCCCCCCC(O)CC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.50
KMT2A Q03164 3/20 0.49
KDM4E B2RXH2 1/20 0.49
DUSP3 P51452 1/20 0.49
MEN1 O00255 1/20 0.49
LMNA P02545 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.47
MAPT P10636 1/20 0.47
ALDH1A1 P00352 2/20 0.47
CYP3A4 P08684 2/20 0.46
TSHR P16473 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
ALOX15 P16050 1/20 0.46
HSD17B10 Q99714 1/20 0.46
ATM Q13315 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
FFAR1 O14842 1/20 0.46
DGKA P23743 1/20 0.46
GAA P10253 1/20 0.44
LPAR6 P43657 1/20 0.43

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
SCHEMBL29264556 1.00 CYP1A2 (0.50) CYP1A2KMT2AKDM4EDUSP3MEN1
SCHEMBL3698102 0.98 CYP1A2 (0.52) CYP1A2KMT2AKDM4EDUSP3MEN1
3-Octanol SCHEMBL28577097 0.93 LMNA (0.54) CYP1A2KMT2AKDM4EDUSP3MEN1
SCHEMBL27363191 0.92 CYP1A2 (0.53) CYP1A2KMT2AKDM4EDUSP3MEN1
SCHEMBL23116488 0.87 FFAR4 (0.62) KMT2AKDM4EDUSP3MEN1LMNA
SCHEMBL7561232 0.87 FFAR4 (0.53) CYP1A2KMT2AKDM4EDUSP3MEN1
SCHEMBL5998784 0.87 FFAR4 (0.62) KMT2AKDM4EDUSP3MEN1LMNA
SCHEMBL5999025 0.87 FFAR4 (0.62) KMT2AKDM4EDUSP3MEN1LMNA
SCHEMBL4524831 0.87 KMT2A (0.60) CYP1A2KMT2AKDM4EDUSP3MEN1
SCHEMBL1664267 0.87 KMT2A (0.60) CYP1A2KMT2AKDM4EDUSP3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0808625-B1 External skin-care composition KAO CORP (JP) 2002-08-07 EP disclosed
EP-0808625-A1 External skin-care composition Kao Corporation (JP) 1997-11-26 EP disclosed
WO-1997035557-A1 EXTERNAL SKIN-CARE COMPOSITION KAO CORPORATION (JP) 1997-10-02 WO disclosed