SCHEMBL10683067

SCHEMBL10683067

CCc1[nH]c(=O)c(C(=O)O)cc1C(=O)c1ccoc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.37
▸ GAA P10253 3/20 0.37
▸ HSD17B10 Q99714 3/20 0.37
▸ HPGD P15428 2/20 0.37
▸ DRD2 P14416 1/20 0.36
▸ TRPA1 O75762 1/20 0.34
▸ ALDH1A1 P00352 3/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ UCHL1 P09936 5/20 0.33
▸ CNR2 P34972 1/20 0.32
▸ UCHL3 P15374 1/20 0.32
▸ TGM2 P21980 1/20 0.32
▸ CASP3 P42574 1/20 0.32
▸ USP5 P45974 1/20 0.32
▸ TMIGD3 P0DMS9 1/20 0.32
▸ ADORA1 P30542 1/20 0.32
▸ PDE3B Q13370 1/20 0.32
▸ PDE3A Q14432 1/20 0.32

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
SCHEMBL10684915 0.89 CDC7 (0.40) DRD2TRPA1ALDH1A1CYP3A4TMIGD3
SCHEMBL10680809 0.86 DRD2 (0.36) KDM4EGAAHSD17B10HPGDDRD2
SCHEMBL10675710 0.85 ALDH1A1 (0.51) KDM4EGAAALDH1A1POLBPDE3B
SCHEMBL10680981 0.85 DRD2 (0.38) GAADRD2TRPA1CYP3A4TMIGD3
SCHEMBL7376126 0.81 PDE3B (0.44) KDM4EGAAHSD17B10HPGDDRD2
SCHEMBL10681150 0.80 UCHL1 (0.50) KDM4EGAAHSD17B10HPGDALDH1A1
SCHEMBL10684520 0.79 UCHL1 (0.46) KDM4EGAAHSD17B10HPGDCYP3A4
SCHEMBL10681743 0.79 PDE3B (0.53) KDM4EGAAHSD17B10HPGDALDH1A1
SCHEMBL10675744 0.79 DRD2 (0.38) KDM4EHPGDDRD2TRPA1ALDH1A1
SCHEMBL10677653 0.77 UCHL1 (0.53) KDM4EGAAHPGDALDH1A1POLB

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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