SCHEMBL10682007

SCHEMBL10682007

CCOC(=O)c1cc(C(=O)c2ccc(C)cc2)c(CC)[nH]c1=O

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 8/20 0.56
▸ MAPT P10636 3/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ LMNA P02545 2/20 0.56
▸ HPGD P15428 2/20 0.49
▸ RAB9A P51151 1/20 0.49
▸ GAA P10253 3/20 0.49
▸ POLB P06746 2/20 0.49
▸ NPC1 O15118 1/20 0.49
▸ KMT2A Q03164 3/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ CDK5 Q00535 1/20 0.43
▸ CDK5R1 Q15078 1/20 0.43
▸ KDM4E B2RXH2 6/20 0.43
▸ PDE3B Q13370 1/20 0.41
▸ PDE3A Q14432 1/20 0.41
▸ GLA P06280 1/20 0.40
▸ ATM Q13315 1/20 0.40

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
SCHEMBL10674925 0.90 ALDH1A1 (0.53) ALDH1A1MAPTL3MBTL1LMNAHPGD
SCHEMBL10679716 0.89 ALDH1A1 (0.52) ALDH1A1MAPTL3MBTL1LMNAHPGD
SCHEMBL10684544 0.88 CDK5 (0.54) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL10676997 0.88 ALDH1A1 (0.53) ALDH1A1MAPTL3MBTL1LMNAHPGD
SCHEMBL10680708 0.86 MAPT (0.49) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL10681150 0.85 UCHL1 (0.50) ALDH1A1MAPTL3MBTL1LMNAHPGD
SCHEMBL10676837 0.84 CDC7 (0.42) ALDH1A1MAPTL3MBTL1LMNAHPGD
SCHEMBL10677717 0.84 ALDH1A1 (0.44) ALDH1A1MAPTL3MBTL1LMNAHPGD
SCHEMBL10675710 0.83 ALDH1A1 (0.51) ALDH1A1MAPTL3MBTL1LMNAGAA
SCHEMBL10676194 0.81 ALDH1A1 (0.52) ALDH1A1MAPTL3MBTL1LMNAHPGD

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-4769380-A Cardiotonic 5-benzoyl-1,2-dihydro-2-oxo-3-pyridinecarboxylates MERRELL DOW PHARMACEUTICALS INC. (US) 1988-09-06 — — US disclosed
Send feedback