SCHEMBL6518880

SCHEMBL6518880

C=C(CC(=O)Oc1ccc(C)cc1)C(=O)OCC(=O)Oc1ccc(C)cc1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.51
LMNA P02545 3/20 0.51
NPC1 O15118 4/20 0.49
TDP1 Q9NUW8 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
KMT2A Q03164 5/20 0.42
MAPT P10636 3/20 0.42
RAB9A P51151 3/20 0.42
SMN1; SMN2 Q16637 3/20 0.42
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
HSD17B10 Q99714 1/20 0.41
MEN1 O00255 3/20 0.40
NLRP3 Q96P20 1/20 0.40
F2 P00734 1/20 0.39

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
SCHEMBL6513746 0.95 GAA (0.50) GAALMNANPC1TDP1L3MBTL1
SCHEMBL6523115 0.94 GAA (0.47) GAALMNANPC1TDP1L3MBTL1
SCHEMBL6520858 0.94 GAA (0.47) GAALMNANPC1TDP1L3MBTL1
SCHEMBL6524374 0.94 LMNA (0.49) GAALMNANPC1TDP1L3MBTL1
SCHEMBL6518818 0.91 LMNA (0.46) GAALMNANPC1TDP1L3MBTL1
SCHEMBL6515903 0.89 MAPT (0.48) GAALMNANPC1L3MBTL1KMT2A
SCHEMBL6524260 0.88 LMNA (0.44) GAALMNANPC1TDP1L3MBTL1
SCHEMBL6514394 0.86 LMNA (0.44) GAALMNANPC1L3MBTL1KMT2A
SCHEMBL6519563 0.85 NPC1 (0.53) LMNANPC1L3MBTL1KMT2AMAPT
SCHEMBL6514765 0.85 LMNA (0.41) GAALMNANPC1TDP1L3MBTL1

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