SCHEMBL9820186

SCHEMBL9820186

CC(O)(CCO)CC(O)O

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL11414197 0.82 TDP1 (0.36) ALDH1A1
SCHEMBL16592163 0.80 TSHR (0.33) ALDH1A1
SCHEMBL7241793 0.79 TSHR (0.33) ALDH1A1
SCHEMBL7740894 0.78 LMNA (0.32)
SCHEMBL4248335 0.78 THRB (0.40)
SCHEMBL16074697 0.78 TSHR (0.33)
SCHEMBL17687581 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL184709 0.76
SCHEMBL28594 0.71
Methylamine SCHEMBL28435419 0.71 ALDH1A1 (0.39) 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-3151617-A None JP disclosed
JP-H03151617-A ELECTROLYTE FOR ELECTROLYTIC CAPACITOR NIPPON CHEMICON CORP 1991-06-27 JP disclosed