SCHEMBL10683554

SCHEMBL10683554

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UCHL1 P09936 2/20 0.43
▸ GAA P10253 3/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ AKR1C3 P42330 2/20 0.37
▸ NPC1 O15118 3/20 0.36
▸ RAB9A P51151 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ SRD5A2 P31213 2/20 0.35
▸ MAPT P10636 3/20 0.35
▸ LMNA P02545 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ POLB P06746 2/20 0.34
▸ AKR1C2 P52895 1/20 0.34

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
SCHEMBL10679912 0.88 CDC7 (0.40) UCHL1GAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL10681150 0.86 UCHL1 (0.50) UCHL1GAAKDM4EHPGDHSD17B10
SCHEMBL10680630 0.86 NPC1 (0.34) GAAKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL10676997 0.86 ALDH1A1 (0.53) GAAKDM4EHPGDALDH1A1NPC1
SCHEMBL10684372 0.83 MAPT (0.34) UCHL1GAAKDM4EALDH1A1SMN1; SMN2
SCHEMBL7380127 0.80 PDE3B (0.46) GAAKDM4EHPGDHSD17B10ALDH1A1
SCHEMBL10680827 0.76 RAB9A (0.35) GAAKDM4EHPGDALDH1A1SMN1; SMN2
SCHEMBL10676837 0.75 CDC7 (0.42) UCHL1GAAHPGDALDH1A1SMN1; SMN2
SCHEMBL10684520 0.75 UCHL1 (0.46) UCHL1GAAKDM4EHPGDHSD17B10
SCHEMBL10995339 0.74 KDM4E (0.46) GAAKDM4EHPGDHSD17B10ALDH1A1

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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