SCHEMBL1275436

SCHEMBL1275436

CCCCCCN(CCCCCC)C(=O)CSCc1cc(CSCC(=O)O)cc(C(C)(C)C)c1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.36
ACAT1 P24752 1/20 0.35
GMNN O75496 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
THRB P10828 1/20 0.34
CYP2C9 P11712 1/20 0.34
BLM P54132 1/20 0.34
HSD17B10 Q99714 1/20 0.34
VCAM1 P19320 2/20 0.33
LMNA P02545 1/20 0.33
RECQL P46063 1/20 0.33
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
F2R P25116 1/20 0.32
EGFR P00533 1/20 0.31
ERBB2 P04626 1/20 0.31
ALDH1A1 P00352 1/20 0.31
CNR2 P34972 1/20 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
SCHEMBL1274604 1.00 HSPA5 (0.36) HSPA5ACAT1GMNNTP53POLB
SCHEMBL1275438 0.84 HSPA5 (0.39) HSPA5GMNNTP53POLBMAPT
SCHEMBL1274606 0.84 HSPA5 (0.39) HSPA5GMNNTP53POLBMAPT
SCHEMBL4633458 0.83 HSPA5 (0.46) HSPA5GMNNTP53MAPTCYP2C9
SCHEMBL1275472 0.82 HSPA5 (0.40) HSPA5MAPTBLMVCAM1LMNA
Dimethylamine SCHEMBL1275473 0.80 HSPA5 (0.47) HSPA5MAPTCYP2C9BLMVCAM1
SCHEMBL1275483 0.78 HSPA5 (0.40) HSPA5CYP2C9
SCHEMBL1274842 0.78 HSPA5 (0.40) HSPA5CYP2C9
SCHEMBL1275783 0.77 ALDH1A1 (0.41) HSPA5POLBMAPTBLMVCAM1
SCHEMBL1275785 0.77 ALDH1A1 (0.41) HSPA5POLBMAPTBLMVCAM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1848768-B1 CROSS-LINKED POLYETHYLENE HAVING EXCELLENT INHIBITION OF SWEAT-OUT AND INSULATION PROPERTIES LG CHEMICAL LTD (KR) 2011-02-09 EP disclosed
US-7452933-B2 Cross-linked polyethylene having excellent inhibition of sweat-out and insulation properties LG CHEM, LTD. (KR) 2008-11-18 US disclosed
EP-1848768-A4 CROSS-LINKED POLYETHYLENE HAVING EXCELLENT INHIBITION OF SWEAT-OUT AND INSULATION PROPERTIES LG CHEMICAL LTD (KR) 2008-06-11 EP disclosed
EP-1848768-A1 CROSS-LINKED POLYETHYLENE HAVING EXCELLENT INHIBITION OF SWEAT-OUT AND INSULATION PROPERTIES LG Chem, Ltd. (KR) 2007-10-31 EP disclosed
WO-2007097511-A1 CROSS-LINKED POLYETHYLENE HAVING EXCELLENT INHIBITION OF SWEAT-OUT AND INSULATION PROPERTIES LG CHEM, LTD. (KR) 2007-08-30 WO disclosed
US-20070203278-A1 CROSS-LINKED POLYETHYLENE HAVING EXCELLENT INHIBITION OF SWEAT-OUT AND INSULATION PROPERTIES LG CHEM, LTD. (KR) 2007-08-30 US disclosed