SCHEMBL10675813

SCHEMBL10675813

CCc1[nH]c(=O)c(C(=O)O)cc1C(=O)c1ccc[nH]1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAPRT Q6XQN6 1/20 0.43
▸ GAA P10253 5/20 0.38
▸ KDM4E B2RXH2 4/20 0.38
▸ HPGD P15428 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ TSHR P16473 1/20 0.37
▸ MAPT P10636 3/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ POLB P06746 2/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ CTDSP1 Q9GZU7 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ UCHL1 P09936 2/20 0.35
▸ UCHL3 P15374 1/20 0.35
▸ TGM2 P21980 1/20 0.35
▸ CASP3 P42574 1/20 0.35
▸ USP5 P45974 1/20 0.35

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
SCHEMBL10684504 0.88 CDC7 (0.40) NAPRTKDM4ETSHRMAPTL3MBTL1
SCHEMBL10677472 0.85 NPC1 (0.38) NAPRTKDM4EHPGDHSD17B10TSHR
SCHEMBL10676194 0.85 ALDH1A1 (0.52) GAAKDM4EHPGDTSHRMAPT
SCHEMBL10678506 0.84 CYP1A2 (0.39) NAPRTKDM4ETSHRMAPTL3MBTL1
SCHEMBL10679720 0.81 PDE3B (0.45) GAAKDM4EHPGDHSD17B10MAPT
SCHEMBL10681150 0.78 UCHL1 (0.50) GAAKDM4EHPGDHSD17B10MAPT
SCHEMBL10672837 0.78 CCND3 (0.38) KDM4ETSHRMAPTL3MBTL1CYP1A2
SCHEMBL10681743 0.77 PDE3B (0.53) NAPRTGAAKDM4EHPGDHSD17B10
SCHEMBL10684520 0.77 UCHL1 (0.46) GAAKDM4EHPGDHSD17B10MAPT
SCHEMBL10677653 0.75 UCHL1 (0.53) GAAKDM4EHPGDMAPTL3MBTL1

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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