SCHEMBL14201012

SCHEMBL14201012

CCCC(C)N(C(=O)CC(C)(C)C)c1cc(C)c(F)cc1Cl

nearest known ligand 0.34

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PSEN1 P49768 2/20 0.32
PSEN2 P49810 2/20 0.32
APH1B Q8WW43 2/20 0.32
NCSTN Q92542 2/20 0.32
APH1A Q96BI3 2/20 0.32
PSENEN Q9NZ42 2/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL14201020 0.92 MLYCD (0.30) L3MBTL1
SCHEMBL14201031 0.91 L3MBTL1 (0.33) L3MBTL1
SCHEMBL14200856 0.89 L3MBTL1 (0.32) L3MBTL1
SCHEMBL14229076 0.87 PSEN1 (0.32) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14201106 0.85 L3MBTL1 (0.31) L3MBTL1
SCHEMBL14201009 0.84 L3MBTL1 (0.33) L3MBTL1
SCHEMBL14228988 0.79 POLB (0.31)
SCHEMBL14200823 0.79 PSEN1 (0.34) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14200779 0.79 PSEN1 (0.32) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL14200854 0.78 L3MBTL1 (0.34) L3MBTL1

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
US-7365093-B2 Endothelin antagonists ABBOTT LABORATORIES (US) 2008-04-29 US disclosed
US-7208517-B1 Endothelin antagonists ABBOTT LABORTORIES (US) 2007-04-24 US disclosed