SCHEMBL368045

SCHEMBL368045

O=C(OCC(O)CO)C(O)C(O)C(O)C(O)CCCCCCCCCCCCCO

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.40
KDM4E B2RXH2 1/20 0.40
DUSP3 P51452 1/20 0.40
DGKA P23743 1/20 0.35
PDE4A P27815 1/20 0.34
PTPN1 P18031 1/20 0.33
USP2 O75604 3/20 0.33
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 2/20 0.33
MAPT P10636 2/20 0.33
HPGD P15428 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
FAAH O00519 4/20 0.31

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
SCHEMBL26915145 0.98 MEN1 (0.39) MEN1KMT2ALMNAKDM4EDUSP3
SCHEMBL22032592 0.98 MEN1 (0.39) MEN1KMT2ALMNAKDM4EDUSP3
SCHEMBL28984432 0.89 MEN1 (0.42) MEN1KMT2ALMNAKDM4EDUSP3
SCHEMBL39606 0.89 MEN1 (0.42) MEN1KMT2ALMNAKDM4EDUSP3
SCHEMBL1134645 0.81 PDE4A (0.52) MEN1KMT2ALMNAKDM4EDUSP3
SCHEMBL5949369 0.81 DGKA (0.50) MEN1KMT2ALMNAKDM4EDUSP3
SCHEMBL21838766 0.80 PTPN1 (0.36) LMNAPDE4APTPN1
SCHEMBL21626309 0.79 PTPN1 (0.36) LMNAPDE4APTPN1
SCHEMBL28806680 0.79 PTPN1 (0.36) LMNAPDE4APTPN1
SCHEMBL28819742 0.79 PTPN1 (0.36) LMNAPDE4APTPN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8541010-B2 Cosmetic composition comprising double-shell nano-structure WOONGJIN COWAY CO., LTD. (KR) 2013-09-24 US disclosed
CN-102327199-B Cosmetic composition comprising double-shell nano-structure WOONGJIN COWAY CO LTD 2013-03-27 CN disclosed
CN-102327199-A Cosmetic composition comprising double-shell nano-structure WOONGJIN COWAY CO LTD 2012-01-25 CN disclosed
US-20120015011-A1 COSMETIC COMPOSITION COMPRISING DOUBLE-SHELL NANO-STRUCTURE WOONGJIN COWAY CO., LTD. (KR) 2012-01-19 US disclosed