SCHEMBL28258709

SCHEMBL28258709

CC(C)(O)CN(CCN(CC(C)(C)O)CC(C)(C)O)CC(C)(C)O

nearest known ligand 0.39

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL1813722 0.86 ALDH1A1 (0.44) ALDH1A1
SCHEMBL30412693 0.85 CA12 (0.33) ALDH1A1
SCHEMBL15987917 0.81 CA12 (0.38) ALDH1A1
SCHEMBL13296464 0.79 CA12 (0.33) ALDH1A1
SCHEMBL19953391 0.79 MAPT (0.36) ALDH1A1
SCHEMBL14503939 0.79 MAPT (0.32) ALDH1A1
SCHEMBL30412178 0.78 ALDH1A1 (0.37) ALDH1A1
SCHEMBL5886704 0.78 ALDH1A1 (0.37) ALDH1A1
SCHEMBL25276314 0.75 MLYCD (0.36) ALDH1A1
SCHEMBL21064402 0.73 CHRM2 (0.32)

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
CN-107190251-B A kind of gold plating liquid and preparation method thereof 广东东硕科技有限公司 2018-11-16 CN claimed