SCHEMBL6524283

SCHEMBL6524283

CCOC(=O)C(C)C(C(=O)O)=C(C(=O)O)C(C)C(=O)OCC

nearest known ligand 0.42

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.42
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.40
HSD17B10 Q99714 1/20 0.40
ALOX15 P16050 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
SOAT1 P35610 1/20 0.39
PIN1 Q13526 1/20 0.37
HCAR2 Q8TDS4 1/20 0.37
MMP8 P22894 2/20 0.36
MEN1 O00255 1/20 0.36
NPC1 O15118 1/20 0.36
KMT2A Q03164 1/20 0.36
TRPA1 O75762 1/20 0.36
CYP2D6 P10635 1/20 0.33

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
SCHEMBL15709922 1.00 ALDH1A1 (0.42) ALDH1A1HPGDLMNAHSD17B10ALOX15
SCHEMBL6524277 1.00 ALDH1A1 (0.42) ALDH1A1HPGDLMNAHSD17B10ALOX15
SCHEMBL15710095 1.00 ALDH1A1 (0.42) ALDH1A1HPGDLMNAHSD17B10ALOX15
SCHEMBL15709919 1.00 ALDH1A1 (0.42) ALDH1A1HPGDLMNAHSD17B10ALOX15
SCHEMBL6521022 0.82 HCAR2 (0.41) ALDH1A1LMNAHSD17B10GAAHCAR2
SCHEMBL6521016 0.82 HCAR2 (0.41) ALDH1A1LMNAHSD17B10GAAHCAR2
SCHEMBL141446 0.82 ALDH1A1 (0.53) ALDH1A1HPGDLMNAHSD17B10ALOX15
SCHEMBL6518548 0.81 ALDH1A1 (0.50) ALDH1A1HSD17B10GAA
SCHEMBL6518556 0.81 ALDH1A1 (0.50) ALDH1A1HSD17B10GAA
SCHEMBL6049861 0.81 ALDH1A1 (0.42) ALDH1A1HPGDLMNAHSD17B10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6958366-B2 Antifouling coating composition and novel resin DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-10-25 US disclosed