SCHEMBL10677653

SCHEMBL10677653

CCc1[nH]c(=O)c(C(=O)O)cc1C(=O)c1ccc(OC)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UCHL1 P09936 1/20 0.53
▸ ALDH1A1 P00352 6/20 0.50
▸ GAA P10253 4/20 0.50
▸ KDM4E B2RXH2 3/20 0.50
▸ POLB P06746 2/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ RXFP1 Q9HBX9 1/20 0.48
▸ MAPT P10636 3/20 0.47
▸ HTT P42858 3/20 0.47
▸ NPC1 O15118 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.44
▸ L3MBTL1 Q9Y468 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ CA2 P00918 1/20 0.44
▸ NPSR1 Q6W5P4 2/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ BRD4 O60885 1/20 0.43
▸ KMT2A Q03164 1/20 0.42
▸ CNR2 P34972 1/20 0.41
▸ LMNA P02545 1/20 0.41

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
SCHEMBL10679788 0.89 MAPT (0.49) UCHL1ALDH1A1GAAKDM4EPOLB
SCHEMBL10679716 0.86 ALDH1A1 (0.52) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL10682046 0.86 MAPT (0.48) ALDH1A1GAAKDM4ESMN1; SMN2RXFP1
SCHEMBL10681150 0.85 UCHL1 (0.50) UCHL1ALDH1A1GAAKDM4ESMN1; SMN2
SCHEMBL10682462 0.85 MAPT (0.53) UCHL1ALDH1A1GAASMN1; SMN2RXFP1
SCHEMBL10684520 0.84 UCHL1 (0.46) UCHL1GAAKDM4EMAPTHTT
SCHEMBL10681743 0.82 PDE3B (0.53) UCHL1ALDH1A1GAAKDM4EMAPT
SCHEMBL7385630 0.81 MAPT (0.45) ALDH1A1GAAKDM4EPOLBSMN1; SMN2
SCHEMBL10680362 0.80 SRD5A2 (0.48) ALDH1A1GAAKDM4EPOLBMAPT
SCHEMBL10683064 0.79 NPC1 (0.50) ALDH1A1GAAKDM4ESMN1; SMN2RXFP1

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
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