SCHEMBL5846735

SCHEMBL5846735

O=C=NC1CC(N=C=O)(C2(N=C=O)CCCC2N=C=O)C1

nearest known ligand 0.36

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL424595 0.81 ALDH1A1 (0.38) ALDH1A1
SCHEMBL8038031 0.77 ALDH1A1 (0.45) ALDH1A1
SCHEMBL8622618 0.73 ALDH1A1 (0.39) ALDH1A1
SCHEMBL14877167 0.71 ALDH1A1 (0.47) ALDH1A1
SCHEMBL10950301 0.68 ALDH1A1 (0.50) ALDH1A1
SCHEMBL7553832 0.66 ALDH1A1 (0.34) ALDH1A1
SCHEMBL11564267 0.65 ALDH1A1 (0.33) ALDH1A1
SCHEMBL2728355 0.64 ALDH1A1 (0.40) ALDH1A1
SCHEMBL106677 0.64 ALDH1A1 (0.45) ALDH1A1
SCHEMBL9134637 0.64 ALDH1A1 (0.32) ALDH1A1

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-7153917-B2 (Co)polymers and method for the radical (co)polymerization of olefinically unsaturate monomers BASF COATINGS AG (DE) 2006-12-26 US disclosed