SCHEMBL20000848

SCHEMBL20000848

CC1=CCCC(=O)C(CC(C)C)N1C

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 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
SCHEMBL28954451 0.64 HDAC6 (0.42) HDAC6
SCHEMBL20000844 0.60 SORT1 (0.40) HDAC6
SCHEMBL11211636 0.60
SCHEMBL14108061 0.59 ABCB1 (0.32)
SCHEMBL2691336 0.59
SCHEMBL9921247 0.59
SCHEMBL24339030 0.58 HDAC6 (0.33) HDAC6
SCHEMBL20776811 0.58 ABCB1 (0.34) HDAC6
SCHEMBL3936215 0.58 FFAR3 (0.33)
SCHEMBL17834070 0.57 PIK3CD (0.33)

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-2018058109-A1 COMPOSITIONS AND METHODS FOR TREATING METABOLIC DISORDERS NUSIRT SCIENCES, INC. (US) 2018-03-29 WO disclosed