SCHEMBL22915535

SCHEMBL22915535

CC(C)C(C)(C(=O)OCC(F)(F)F)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.48
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MMP8 P22894 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
SCHEMBL8362708 0.81 HTT (0.31) HTT
SCHEMBL12321027 0.79 HTT (0.44) HTTMMP8
SCHEMBL24909690 0.78 HTT (0.52) HTTMEN1ALDH1A1TSHRKMT2A
SCHEMBL19857462 0.78 HTT (0.50) HTTMEN1ALDH1A1TSHRKMT2A
SCHEMBL2692345 0.78 HTT (0.50) HTTMEN1ALDH1A1TSHRKMT2A
SCHEMBL23005578 0.78 HTT (0.50) HTTMEN1ALDH1A1TSHRKMT2A
SCHEMBL10226723 0.77 HTT (0.42) HTTMMP8
SCHEMBL10228187 0.77 HTT (0.42) HTT
SCHEMBL21252696 0.76 HTT (0.45) HTT
SCHEMBL15521269 0.76 HTT (0.45) HTTMMP8

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-20210024991-A1 FLOW CELLS ILLUMINA, INC. 2021-01-28 US disclosed