SCHEMBL11517580

SCHEMBL11517580

CCCC[CH]C(O)CCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 2/20 0.35
TRPA1 O75762 1/20 0.35
DDAH1 O94760 1/20 0.35
GAPDH P04406 1/20 0.35
LMNA P02545 4/20 0.35
TSHR P16473 3/20 0.35
HSD17B10 Q99714 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP2D6 P10635 2/20 0.32
ACHE P22303 1/20 0.32
BACE1 P56817 1/20 0.32
SPHK1 Q9NYA1 1/20 0.32
GMNN O75496 1/20 0.32
POLB P06746 1/20 0.32
THPO P40225 1/20 0.32
MTOR P42345 1/20 0.32
BLM P54132 1/20 0.32

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
SCHEMBL29013339 0.91 LMNA (0.42) ALDH1A1MAPTLMNATSHRHSD17B10
SCHEMBL29013338 0.91 LMNA (0.42) ALDH1A1MAPTLMNATSHRHSD17B10
SCHEMBL29013305 0.91 LMNA (0.42) ALDH1A1MAPTLMNATSHRHSD17B10
SCHEMBL2360898 0.86 ACHE (0.42) ALDH1A1SMN1; SMN2MAPTTRPA1DDAH1
SCHEMBL4552804 0.84 TRPA1 (0.50) MAPTTRPA1DDAH1GAPDHLMNA
SCHEMBL9633053 0.81 THRB (0.32)
SCHEMBL2369749 0.81
SCHEMBL289814 0.80
SCHEMBL11191795 0.79 LMNA (0.44) ALDH1A1SMN1; SMN2MAPTTRPA1DDAH1
SCHEMBL14655871 0.79 LMNA (0.50) ALDH1A1SMN1; SMN2MAPTTRPA1DDAH1

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-4177073-A TO INCREASE VISCOSITY OF COATING SOLUTION OJI PAPER CO., LTD. (JP) 1979-12-04 US disclosed