SCHEMBL14200633

SCHEMBL14200633

CCCc1ccnc(N(CCC(C)(C)C)C(C)CCC)n1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ACACB O00763 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
SCHEMBL14200646 0.93 KCNH2 (0.31) ACACB
SCHEMBL14200658 0.91 KCNH2 (0.31) ACACB
SCHEMBL14200607 0.91 DYRK1A (0.30) ACACB
SCHEMBL14200640 0.91 ACACB (0.32) ACACB
SCHEMBL14200662 0.88 ACACB (0.30) ACACB
SCHEMBL14200738 0.86 KCNH2 (0.33) ACACB
SCHEMBL14229382 0.85 KCNH2 (0.32)
SCHEMBL14200641 0.84 ACACB (0.30) ACACB
SCHEMBL14200664 0.84 KCNH2 (0.32) ACACB
SCHEMBL14200712 0.84 CRHR1 (0.30)

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 3 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
US-7208517-B1 Endothelin antagonists ABBOTT LABORTORIES (US) 2007-04-24 US disclosed