SCHEMBL28046890

SCHEMBL28046890

CCCC[C]1CC(C)CC(C)(C)C1

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.35
NPSR1 Q6W5P4 1/20 0.32
GAA P10253 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
ACE2 Q9BYF1 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
SCHEMBL11720260 0.79 ALDH1A1 (0.38) ALDH1A1NPSR1GAATDP1
SCHEMBL10987010 0.67 ALDH1A1 (0.43) ALDH1A1NPSR1GAATDP1
SCHEMBL5918165 0.66 ALDH1A1 (0.40) ALDH1A1NPSR1GAATDP1
SCHEMBL9308704 0.64 ALDH1A1 (0.36) ALDH1A1NPSR1GAATDP1
SCHEMBL2113997 0.64 ALDH1A1 (0.36) ALDH1A1NPSR1GAATDP1
SCHEMBL3475479 0.62
SCHEMBL74182 0.62
SCHEMBL97615 0.61
SCHEMBL1931577 0.60 ALDH1A1 (0.43) ALDH1A1NPSR1GAATDP1
SCHEMBL72009 0.60 CYP1A2 (0.39) ALDH1A1GAA

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-104105664-B Process for preparing aluminosilicate zeolite SSZ-56 CHEVRON U.S.A. INC. (US) 2016-01-13 CN disclosed