SCHEMBL30784346

SCHEMBL30784346

CCOC(=O)/N=C\CONC=O

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.33
ALOX15 P16050 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
PKM P14618 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL30701924 1.00 GAA (0.33) GAAALOX15MGAMSIMGAM2
SCHEMBL30784314 1.00 GAA (0.33) GAAALOX15MGAMSIMGAM2
SCHEMBL9389710 0.77 ALDH1A1 (0.39) GAAALOX15MGAMSIMGAM2
SCHEMBL1516900 0.76 ALDH1A1 (0.37) GAAALOX15MGAMSIMGAM2
SCHEMBL4656131 0.76 ALDH1A1 (0.37) GAAALOX15MGAMSIMGAM2
SCHEMBL2873888 0.76 ALDH1A1 (0.37) GAAALOX15MGAMSIMGAM2
SCHEMBL3176109 0.73
SCHEMBL472211 0.71
SCHEMBL4607972 0.68 ALDH1A1 (0.37) GAAALOX15MGAMSIMGAM2
SCHEMBL17737748 0.67

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
WO-2024026424-A1 QUINAZOLINONE DERIVATIVES AS AND RELATED USES BLACK DIAMOND THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed