SCHEMBL6258273

SCHEMBL6258273

CCCCCCCCCCCCCCCCOC(=O)C(CCCCCCCCCCCCCC)OC(C)=O

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.47
NAAA Q02083 1/20 0.47
ALDH1A1 P00352 2/20 0.47
EPHX1 P07099 1/20 0.44
FAAH O00519 2/20 0.44
ZDHHC7 Q9NXF8 1/20 0.42
PRKCA P17252 2/20 0.42
CES2 O00748 1/20 0.42
MAPT P10636 1/20 0.42
HCAR2 Q8TDS4 1/20 0.41
RAD52 P43351 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
LMNA P02545 1/20 0.40

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
SCHEMBL8376617 1.00 TSHR (0.47) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL8380705 1.00 TSHR (0.47) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL10473435 1.00 TSHR (0.47) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL4334515 1.00 TSHR (0.47) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL1681497 0.97 ALDH1A1 (0.52) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL15910275 0.97 ALDH1A1 (0.52) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL8376851 0.97 ALDH1A1 (0.52) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL6259986 0.94 FAAH (0.43) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL6262611 0.94 FAAH (0.43) TSHRNAAAALDH1A1EPHX1FAAH
SCHEMBL15903070 0.93 FAAH (0.44) TSHRNAAAALDH1A1FAAHZDHHC7

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-6531143-B1 Wax diesters containing alpha-hydroxy fatty acids esterified with fatty acids and higher alcohols KANEBO, LIMITED (JP) 2003-03-11 US claimed
EP-1084693-B1 ALPHA-HYDROXY FATTY ACID DERIVATIVES AND COMPOSITION FOR EXTERNAL USE CONTAINING THE SAME KANEBO COSMETICS INC (JP) 2005-10-05 EP disclosed
US-6531143-B1 Wax diesters containing alpha-hydroxy fatty acids esterified with fatty acids and higher alcohols KANEBO, LIMITED (JP) 2003-03-11 US disclosed
EP-1084693-A1 $g(a)-HYDROXY FATTY ACID DERIVATIVES AND COMPOSITION FOR EXTERNAL USE CONTAINING THE SAME Kanebo Limited (JP) 2001-03-21 EP disclosed