SCHEMBL8398449

SCHEMBL8398449

C=CCOC(C1CO1)C(O)C1CO1

nearest known ligand 0.37

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.37

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
SCHEMBL7636497 0.86 ALDH1A1 (0.43) ALDH1A1
SCHEMBL7640879 0.86 ALDH1A1 (0.43) ALDH1A1
SCHEMBL7638809 0.86 ALDH1A1 (0.43) ALDH1A1
SCHEMBL786695 0.71
SCHEMBL15422812 0.71 ALDH1A1 (0.41) ALDH1A1
SCHEMBL6049883 0.71
SCHEMBL1074227 0.71 ALDH1A1 (0.41) ALDH1A1
Ammonia Solution, Strong SCHEMBL7713247 0.68 ALDH1A1 (0.38) ALDH1A1
SCHEMBL7748902 0.67 ALDH1A1 (0.37) ALDH1A1
SCHEMBL7748899 0.67 ALDH1A1 (0.37) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-11035602-A None JP disclosed
JP-H1135602-A POLYSACCHARIDE DERIVATIVE AND REAGENT FOR OPTICAL RESOLUTION UBE IND LTD 1999-02-09 JP disclosed