SCHEMBL6284476

SCHEMBL6284476

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

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.50
HSPD1 P10809 1/20 0.50
HSPE1 P61604 1/20 0.50
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.45
HSD17B10 Q99714 1/20 0.45
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
CPT2 P23786 1/20 0.33
ACLY P53396 1/20 0.33
LMNA P02545 1/20 0.32
PTPN2 P17706 1/20 0.31
PTPN1 P18031 1/20 0.31
CDC25B P30305 1/20 0.31
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
ACACB O00763 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
SCHEMBL689651 0.83 BLM (0.44) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL1309987 0.81 HSPD1 (0.63) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL27243091 0.81 BLM (0.77) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL1542449 0.81 BLM (0.77) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL20394031 0.80 HSPD1 (0.71) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL14672441 0.79 HSPD1 (0.73) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL429973 0.79 HSPD1 (0.73) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL27449447 0.79 HSPD1 (0.73) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL8416049 0.79 HSPD1 (0.73) BLMHSPD1HSPE1MEN1KMT2A
SCHEMBL6286432 0.79 HSPD1 (0.73) BLMHSPD1HSPE1MEN1KMT2A

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-6969738-B2 Malic acid diester surfactants AIR PRODUCTS AND CHEMICALS, INC. (US) 2005-11-29 US disclosed
US-20020103280-A1 Malic acid diester surfactants LASSILA KEVIN RODNEY (US) 2002-08-01 US disclosed
US-6369146-B1 AN AQUEOUS ORGANIC COATING COMPRISING A RESIN, SURFACTANT, WETTING AGENT, FLOW AND LEVELING AGENTS AND AN HYDROXY DIALKYL(C3-6) MALEATE; REDUCED EQUILIBRIUM AND DYNAMIC SURFACE TENSION; COATINGS; INKS; ADHESIVES; HERBICIDES AIR PRODUCTS AND CHEMICALS, INC. 2002-04-09 US disclosed
EP-1095988-A2 Malic acid diester surfactants AIR PRODUCTS AND CHEMICALS, INC. (US) 2001-05-02 EP disclosed