SCHEMBL11705752

SCHEMBL11705752

CC(C)(C)c1ccc(Oc2ccc(C(F)(F)F)cc2N)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.77
RAB9A P51151 3/20 0.77
MAPT P10636 7/20 0.71
LMNA P02545 1/20 0.71
ATM Q13315 1/20 0.71
NPSR1 Q6W5P4 1/20 0.62
ALDH1A1 P00352 2/20 0.51
HPGD P15428 2/20 0.51
MAPK1 P28482 2/20 0.51
NPC1 O15118 1/20 0.51
SLC6A4 P31645 4/20 0.46
HTR2A P28223 3/20 0.46
KCNH2 Q12809 3/20 0.46
KDM4E B2RXH2 3/20 0.44
MEN1 O00255 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
KMT2A Q03164 1/20 0.44

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
SCHEMBL14681242 0.90 L3MBTL1 (0.81) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL31090839 0.90 L3MBTL1 (0.81) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL3281979 0.87 L3MBTL1 (0.77) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL2978238 0.87 L3MBTL1 (1.00) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL29766701 0.87 L3MBTL1 (0.77) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL11706565 0.85 MAPT (0.72) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL1340730 0.84 L3MBTL1 (0.72) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL11385841 0.83 L3MBTL1 (0.71) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL11708266 0.83 L3MBTL1 (0.71) L3MBTL1RAB9AMAPTLMNAATM
SCHEMBL11706836 0.83 MAPT (0.69) L3MBTL1RAB9AMAPTLMNAATM

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-4065448-A Tertiary alkyl substituted disazo pigments CIBA-GEIGY AG (CH) 1977-12-27 US disclosed