SCHEMBL14200740

SCHEMBL14200740

CCCCc1ccnc(N(CCC(C)(C)C)C(CCC)CCC)n1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 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
SCHEMBL14200742 0.95 KCNH2 (0.32) KCNH2
SCHEMBL14200662 0.92 ACACB (0.30)
SCHEMBL14200706 0.91 KCNH2 (0.33) KCNH2
SCHEMBL14200712 0.90 CRHR1 (0.30)
SCHEMBL14200646 0.89 KCNH2 (0.31) KCNH2
SCHEMBL14200642 0.88
SCHEMBL14228953 0.88 KCNH2 (0.36) KCNH2
SCHEMBL14200648 0.86 CRHR1 (0.31)
SCHEMBL14200738 0.85 KCNH2 (0.33) KCNH2
SCHEMBL14200664 0.85 KCNH2 (0.32) KCNH2

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 4 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-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