SCHEMBL8339223

SCHEMBL8339223

CC(C)NC(=O)OCC(=O)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.51
ALDH1A1 P00352 5/20 0.50
LMNA P02545 4/20 0.50
SMN1; SMN2 Q16637 4/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
GAA P10253 1/20 0.50
ALOX12 P18054 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
RXFP1 Q9HBX9 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
POLB P06746 1/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
HPGD P15428 1/20 0.47
ERCC5 P28715 1/20 0.47
FEN1 P39748 1/20 0.47
HAO1 Q9UJM8 1/20 0.47
RAB9A P51151 4/20 0.47
NPC1 O15118 3/20 0.47
PDCD1 Q15116 1/20 0.46

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
SCHEMBL8341968 0.91 NPC1 (0.51) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL8338779 0.86 ALDH1A1 (0.64) MAPTALDH1A1SMN1; SMN2ALOX12NPSR1
SCHEMBL8340977 0.83 NPC1 (0.54) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL8335416 0.82 KDM4E (0.47) ALDH1A1LMNAPOLBKMT2AHPGD
SCHEMBL8341523 0.82 L3MBTL1 (0.49) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL8338985 0.81 ESR2 (0.56) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL11758104 0.78 MAPT (0.62) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL21852781 0.78 MAPT (0.56) MAPTALDH1A1LMNASMN1; SMN2L3MBTL1
SCHEMBL4067128 0.77 ALDH1A1 (0.71) MAPTALDH1A1LMNASMN1; SMN2GAA
SCHEMBL8338666 0.75 ALDH1A1 (0.60) MAPTALDH1A1LMNASMN1; SMN2GAA

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-5968975-A TREATING ATHEROSCLEROSIS AMERICAN HOME PRODUCTS CORPORATION (US) 1999-10-19 US disclosed