SCHEMBL5616059

SCHEMBL5616059

O=C1OCC2CCCCC2COC1=O

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.37
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL460145 0.84 MAPT (0.33) ALDH1A1MAPTMEN1KMT2A
SCHEMBL10344281 0.83 ALDH1A1 (0.37) ALDH1A1MAPT
SCHEMBL10579900 0.83 ALDH1A1 (0.37) ALDH1A1MAPT
SCHEMBL19022224 0.80 CEL (0.34) ALDH1A1MAPTMEN1KMT2A
SCHEMBL3902389 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL9418314 0.77 CA1 (0.48) ALDH1A1KMT2A
SCHEMBL8815894 0.77 ALDH1A1 (0.32) ALDH1A1
SCHEMBL195524 0.77 MAPT (0.33) ALDH1A1MAPT
SCHEMBL18984549 0.76 KCNJ1 (0.33) ALDH1A1MAPT
Ethylene Glycol SCHEMBL487137 0.76 MEN1 (0.31) ALDH1A1MEN1KMT2A

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
EP-1763526-A1 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS Altana Pharma AG (DE) 2007-03-21 EP disclosed
WO-2006000589-A1 4,6-DISUBSTITUTED PYRIMIDINES AND THEIR USE AS PROTEIN KINASE INHIBITORS ALTANA PHARMA AG (DE) 2006-01-05 WO disclosed
JP-2005088274-A BIODEGRADABLE LAMINATED PAPER UBE IND LTD 2005-04-07 JP disclosed