SCHEMBL7215285

SCHEMBL7215285

CC(=O)CC(C)CCCC(C)O

nearest known ligand 0.44

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.44
TDP1 Q9NUW8 1/20 0.44
BLM P54132 1/20 0.38
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
PTPN1 P18031 1/20 0.32
ACE2 Q9BYF1 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
SCHEMBL1786816 0.84 BLM (0.54) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL12713322 0.82 BLM (0.57) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL15202976 0.82 BLM (0.57) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL17249627 0.82 BLM (0.57) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL11760483 0.82 ALDH1A1 (0.44) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL11762046 0.80 ALDH1A1 (0.42) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL13176558 0.79 ALDH1A1 (0.46) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL1369967 0.79 ALDH1A1 (0.46) ALDH1A1TDP1MAPTACE2
SCHEMBL11765028 0.78 ALDH1A1 (0.41) ALDH1A1TDP1BLMLMNAPTPN1
SCHEMBL2637623 0.78 ACE2 (0.55) ALDH1A1TDP1BLMLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1343834-A2 THE ENCAPSULATION OF ACTIVES IN CORE-SHELL AND GEL PARTICLES Dow Corning Corporation (US) 2003-09-17 EP disclosed
WO-2002050166-A2 THE ENCAPSULATION OF ACTIVES IN CORE-SHELL AND GEL PARTICLES DOW CORNING CORPORATION (US) 2002-06-27 WO disclosed