SCHEMBL13430641

SCHEMBL13430641

BC(C)(C)CC(C)(C)C1CO1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL13259251 0.81 ALDH1A1 (0.32) ALDH1A1
SCHEMBL20444777 0.79 ALDH1A1 (0.31) ALDH1A1
SCHEMBL11918119 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL22211294 0.77 ALDH1A1 (0.30) ALDH1A1
SCHEMBL4639388 0.72
SCHEMBL15995099 0.72
SCHEMBL17722441 0.70
SCHEMBL2821699 0.68
SCHEMBL16687635 0.67 ALDH1A1 (0.30) ALDH1A1
SCHEMBL18844662 0.66 CYP1A2 (0.30)

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
WO-2010044585-A2 PIPERIDINE COMPOUNDS, PHARMACEUTICAL COMPOSITION COMPRISING THE SAME AND ITS USE SK HOLDINGS CO., LTD. (KR) 2010-04-22 WO disclosed