SCHEMBL7773503

SCHEMBL7773503

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

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSPD1 P10809 1/20 0.50
BLM P54132 1/20 0.50
HSPE1 P61604 1/20 0.50
CPT2 P23786 1/20 0.50
ACLY P53396 1/20 0.50
GPR84 Q9NQS5 3/20 0.46
FFAR1 O14842 1/20 0.46
MEN1 O00255 1/20 0.45
HPGD P15428 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
HSD17B10 Q99714 1/20 0.45
FDPS P14324 7/20 0.40
GGPS1 O95749 4/20 0.40
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 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
SCHEMBL1354984 1.00 HSPD1 (0.50) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL8990173 1.00 HSPD1 (0.50) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL30236384 1.00 HSPD1 (0.50) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL7063689 0.98 CPT2 (0.52) HSPD1BLMHSPE1CPT2ACLY
Hydrochloric Acid SCHEMBL28182927 0.95 CPT2 (0.48) HSPD1BLMHSPE1CPT2ACLY
Phosphoric Acid SCHEMBL28919711 0.93 FDPS (0.47) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL2979037 0.92 CPT2 (0.53) HSPD1BLMHSPE1CPT2ACLY
Glycerin SCHEMBL28861479 0.91 CPT2 (0.46) HSPD1BLMHSPE1CPT2ACLY
SCHEMBL11225040 0.87 HSPD1 (0.43) HSPD1BLMHSPE1CPT2ACLY
O-Xylene SCHEMBL29004500 0.85 GAA (0.42) HSPD1BLMHSPE1CPT2ACLY

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
EP-0721446-B1 CHIRAL SURFACTANTS AND METHODS FOR THEIR USE IN CHIRAL SEPARATIONS WATERS CORP (US) 2001-07-18 EP disclosed
US-6090250-A CAPILLARY ELECTROPHORESIS CHROMATOGRAPHY USING AN ANIONIC SURFACTANT HAVING A HYDROPHOBIC TAIL IN A CHANNEL WITH AN ELECTROLYTE SOLUTION WHERE THE COMPOUND, E.G., ASPARTAME, IS INJECTED, VOLTAGE APPLIED AND MICELLES FORMED; HIGH SPEED WATERS INVESTMENTS LIMITED (US) 2000-07-18 US disclosed
EP-0721446-A1 CHIRAL SURFACTANTS AND METHODS FOR THEIR USE IN CHIRAL SEPARATIONS Waters Corporation (US) 1996-07-17 EP disclosed
WO-1995008529-A1 CHIRAL SURFACTANTS AND METHODS FOR THEIR USE IN CHIRAL SEPARATIONS WATERS CORPORATION (US) 1995-03-30 WO disclosed