SCHEMBL15399424

SCHEMBL15399424

C=C(C)C(=O)OC1CC(C)CCC1(C)P(=O)(O)O

nearest known ligand 0.30

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL21051146 0.83
SCHEMBL9632895 0.82 ALDH1A1 (0.31) ALDH1A1
SCHEMBL23494211 0.72 ALDH1A1 (0.33) ALDH1A1
SCHEMBL23699841 0.68 ALDH1A1 (0.32) ALDH1A1
SCHEMBL19116183 0.67 ALDH1A1 (0.34) ALDH1A1
SCHEMBL28527612 0.67 ALDH1A1 (0.34) ALDH1A1
SCHEMBL23494086 0.67 ALDH1A1 (0.34) ALDH1A1
SCHEMBL15399425 0.67 ALDH1A1 (0.31) ALDH1A1
SCHEMBL27922435 0.67 ALDH1A1 (0.31) ALDH1A1
SCHEMBL9861731 0.66 CYP19A1 (0.42) 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-20140001155-A1 MANUFACTURING METHOD OF MAGNETIC DISK SUBSTRATE KAO CORPORATION (JP) 2014-01-02 US disclosed