SCHEMBL6749773

SCHEMBL6749773

CC(C)(C)C#Cc1ccc(OCCCCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ACACB O00763 3/20 0.33
HAO1 Q9UJM8 1/20 0.33
APP P05067 7/20 0.32
MCHR1 Q99705 1/20 0.32
HRH3 Q9Y5N1 1/20 0.32

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
SCHEMBL4870514 0.77 ATM (0.42)
SCHEMBL17481962 0.75 ACACB (0.45) ACACBHAO1APPMCHR1
SCHEMBL9141866 0.74 NR5A1 (0.50) APP
SCHEMBL4870458 0.73 KDM4E (0.40)
SCHEMBL2020660 0.72 ALDH1A1 (0.47)
SCHEMBL5489747 0.71 MAOB (0.35)
SCHEMBL5959986 0.70 KCNA3 (0.50)
SCHEMBL27096233 0.70 HRH3 (0.43) APPHRH3
SCHEMBL1751270 0.70 APP (0.34) APP
SCHEMBL4401763 0.69

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-6703082-B1 VARIOUS NAPHTHALENE-CONTAINING LIQUID CRYSTALS DISPLAYTECH, INC. 2004-03-09 US disclosed