SCHEMBL30366229

SCHEMBL30366229

O=Cc1cc(O)c(O)c(O)c1C=O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.45
ERN1 O75460 11/20 0.45
TRIM24 O15164 1/20 0.41
TRIM33 Q9UPN9 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
SCHEMBL1527084 1.00 PIM1 (0.45) PIM1ERN1TRIM24TRIM33
SCHEMBL27396923 0.82 ERN1 (0.48) PIM1ERN1TRIM24TRIM33
SCHEMBL769026 0.82 ERN1 (0.52) PIM1ERN1TRIM24TRIM33
SCHEMBL31648926 0.82 CYP3A4 (0.48) ERN1
SCHEMBL7896054 0.82 CYP3A4 (0.48) ERN1
SCHEMBL28441918 0.76 ERN1 (0.44) ERN1
SCHEMBL29955713 0.76 CYP3A4 (0.53) ERN1
SCHEMBL28441941 0.76 ERN1 (0.42) ERN1
SCHEMBL27452224 0.76 ERN1 (0.52) ERN1
SCHEMBL15789362 0.76 ERN1 (0.47) PIM1ERN1TRIM24TRIM33

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240392220-A1 BRANDY REPLICAS AVA FOOD LABS, INC. 2024-11-28 US disclosed
EP-4408967-A1 BRANDY REPLICAS AVA FOOD LABS, INC. (US) 2024-08-07 EP disclosed
WO-2023055801-A1 BRANDY REPLICAS AVA FOOD LABS, INC. (US) 2023-04-06 WO disclosed