SCHEMBL5657458

SCHEMBL5657458

CC(C)CCCCCCCCCCCC(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 2/20 0.55
PLA2G5 P39877 2/20 0.55
NOD1 Q9Y239 3/20 0.54
ALDH1A1 P00352 2/20 0.53
FOLH1 Q04609 7/20 0.53
PLA2G10 O15496 2/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
FAAH O00519 1/20 0.48
MAPT P10636 1/20 0.47
SLC6A5 Q9Y345 1/20 0.47

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
SCHEMBL22923660 1.00 PLA2G2A (0.55) PLA2G2APLA2G5NOD1ALDH1A1FOLH1
SCHEMBL4027352 0.93 PLA2G2A (0.61) PLA2G2APLA2G5NOD1ALDH1A1FOLH1
SCHEMBL15623775 0.91 ALDH1A1 (0.62) PLA2G2APLA2G5NOD1ALDH1A1FOLH1
SCHEMBL11676490 0.87 PLA2G2A (0.72) PLA2G2APLA2G5NOD1ALDH1A1PLA2G10
SCHEMBL542910 0.87 PLA2G2A (0.72) PLA2G2APLA2G5NOD1ALDH1A1PLA2G10
SCHEMBL23833964 0.87 PLA2G2A (0.72) PLA2G2APLA2G5NOD1ALDH1A1PLA2G10
SCHEMBL19200047 0.87 ALDH1A1 (0.58) PLA2G2APLA2G5NOD1ALDH1A1FOLH1
SCHEMBL7325048 0.87 PLA2G2A (0.72) PLA2G2APLA2G5NOD1ALDH1A1PLA2G10
SCHEMBL4741208 0.87 PLA2G2A (0.72) PLA2G2APLA2G5NOD1ALDH1A1PLA2G10
SCHEMBL25183155 0.87 PLA2G2A (0.72) PLA2G2APLA2G5NOD1ALDH1A1PLA2G10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7109364-B2 Group of anti-cancer compounds with specific structure and their production method YANG ZHENHUA 2006-09-19 US claimed
US-20040034242-A1 Group of anti-cancer compounds with specific structure and their production method YANG ZHENHUA (US) 2004-02-19 US claimed
US-7109364-B2 Group of anti-cancer compounds with specific structure and their production method YANG ZHENHUA 2006-09-19 US disclosed
EP-1259470-A4 A GROUP OF ANTI-CANCER COMPOUNDS WITH SPECIFIC STRUCTURE AND THEIR PRODUCTION METHOD YANG ZHENHUA (US) 2005-06-15 EP disclosed
US-20040034242-A1 Group of anti-cancer compounds with specific structure and their production method YANG ZHENHUA (US) 2004-02-19 US disclosed
EP-1259470-A2 A GROUP OF ANTI-CANCER COMPOUNDS WITH SPECIFIC STRUCTURE AND THEIR PRODUCTION METHOD Yang, Zhenhua (US) 2002-11-27 EP disclosed
WO-2001059067-A2 A GROUP OF ANTI-CANCER COMPOUNDS WITH SPECIFIC STRUCTURE AND THEIR PRODUCTION METHOD YANG ZHENHUA (US) 2001-08-16 WO disclosed