SCHEMBL5264518

SCHEMBL5264518

CC(C)(C)c1ccc(C2=CC=CC[CH]2)cc1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 4/20 0.39
TSHR P16473 1/20 0.35
HTR1D P28221 1/20 0.35
ADRA1A P35348 1/20 0.35
NISCH Q9Y2I1 1/20 0.35
LMNA P02545 2/20 0.34
TYR P14679 1/20 0.34
NPC1 O15118 5/20 0.34
RAB9A P51151 5/20 0.34
KDM4E B2RXH2 2/20 0.32
XDH P47989 1/20 0.32
FGF23 Q9GZV9 1/20 0.31
TP53 P04637 2/20 0.31
MITF O75030 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CYP1A2 P05177 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
SCHEMBL2155033 0.80 KIF11 (0.44) KIF11
SCHEMBL2153842 0.77 RIPK1 (0.32)
SCHEMBL10682585 0.75 CYP1A2 (0.34) TSHRLMNANPC1RAB9ASMN1; SMN2
SCHEMBL2154033 0.74 CA1 (0.41) TSHRNISCHLMNANPC1RAB9A
SCHEMBL6041001 0.74 ALDH1A1 (0.35) LMNAALDH1A1
SCHEMBL27987679 0.72 KIF11 (0.43) KIF11TSHRHTR1DADRA1ANISCH
SCHEMBL4774276 0.71 MAPT (0.40) KIF11NISCHLMNAKDM4ETP53
SCHEMBL3423876 0.67 KIF11 (0.70) KIF11TSHRHTR1DADRA1ANISCH
SCHEMBL26915 0.67 KIF11 (0.70) KIF11TSHRHTR1DADRA1ANISCH
Formaldehyde SCHEMBL27609400 0.67 KIF11 (0.38) KIF11TSHRHTR1DADRA1ANISCH

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1836208-A2 AMINO-IMIDAZOLONES FOR THE INHIBITION OF ß-SECRETASE Wyeth Incoporated (US) 2007-09-26 EP disclosed
WO-2006076284-A2 AMINO-IMIDAZOLONES FOR THE INHIBITION OF ß-SECRETASE WYETH (US) 2006-07-20 WO disclosed