SCHEMBL3280993

SCHEMBL3280993

CCCCCC(CCCCC)(C(=O)O)C(CCCCC)(C(=O)O)C(O)C(O)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 7/20 0.37
FFAR1 O14842 1/20 0.37
MEN1 O00255 1/20 0.33
HPGD P15428 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
HSD17B10 Q99714 1/20 0.33
HSPD1 P10809 1/20 0.33
BLM P54132 1/20 0.33
HSPE1 P61604 1/20 0.33
MAPT P10636 1/20 0.33
LCK P06239 1/20 0.33
PPARD Q03181 1/20 0.33
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
CES2 O00748 1/20 0.32
PGD P52209 1/20 0.31
FFAR4 Q5NUL3 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
SCHEMBL3289667 0.98 GPR84 (0.40) GPR84FFAR1MEN1HPGDRECQL
SCHEMBL3284523 0.86 PGD (0.34) PGD
SCHEMBL3282808 0.83 ACACB (0.38) GPR84FFAR1BLM
SCHEMBL6567474 0.75 HSPD1 (0.43) GPR84FFAR1MEN1HPGDRECQL
SCHEMBL28015102 0.74 AKR1B1 (0.46) GPR84FFAR1MEN1KMT2AHSD17B10
SCHEMBL3285283 0.74 PGD (0.35) PGD
SCHEMBL337305 0.72 CES2 (0.48) GPR84FFAR1MEN1KMT2AHSD17B10
SCHEMBL26101912 0.72 CES2 (0.48) GPR84FFAR1MEN1KMT2AHSD17B10
SCHEMBL13517894 0.72 AKR1B1 (0.44) GPR84FFAR1MEN1KMT2AHSD17B10
SCHEMBL13517692 0.71 FDPS (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100172851-A1 Hydroxy-oligocarboxylic esters: effects on nerve and use for cutaneous and mucocutaneous organs or sites YU RUEY J 2010-07-08 US disclosed
US-7709014-B2 Hydroxy-oligocarboxylic esters: effects on nerve and use for cutaneous and mucocutaneous organs or sites YU RUEY J 2010-05-04 US disclosed
EP-1937246-A2 HYDROXY-OLIGOCARBOXYLIC ESTERS: EFFECTS ON NERVE AND USE FOR CUTANEOUS AND MUCOCUTANEOUS ORGANS OR SITES Yu, Ruey J., Dr. (US) 2008-07-02 EP disclosed
US-20070093551-A1 Hydroxy-oligocarboxylic esters: effects on nerve and use for cutaneous and mucocutaneous organs or sites YU RUEY J 2007-04-26 US disclosed
WO-2007047486-A2 HYDROXY-OLIGOCARBOXYLIC ESTERS: EFFECTS ON NERVE AND USE FOR CUTANEOUS AND MUCOCUTANEOUS ORGANS OR SITES YU RUEY J (US) 2007-04-26 WO disclosed