SCHEMBL15869735

SCHEMBL15869735

Cc1ccc(C#Cc2cccc3c4c([nH]c23)C[C@@H]2CC[C@H]4N2C)cn1

nearest known ligand 0.49

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 18/20 0.49

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
SCHEMBL15869775 1.00 SIGMAR1 (0.49) SIGMAR1
SCHEMBL1987507 1.00 SIGMAR1 (0.49) SIGMAR1
SCHEMBL1985449 0.80 SIGMAR1 (0.53) SIGMAR1
SCHEMBL1992104 0.77 SIGMAR1 (0.49) SIGMAR1
SCHEMBL15869705 0.77 SIGMAR1 (0.49) SIGMAR1
SCHEMBL15869747 0.77 SIGMAR1 (0.49) SIGMAR1
SCHEMBL1986397 0.77 SIGMAR1 (0.49) SIGMAR1
SCHEMBL1986086 0.76 CYP1A2 (0.30)
SCHEMBL1988370 0.73 SIGMAR1 (0.67) SIGMAR1
SCHEMBL1986973 0.73 CHRNA7 (0.45) SIGMAR1

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-8778959-B2 AZA-bridged ring-fused indoles and indolines ABBVIE INC. (US) 2014-07-15 US claimed
US-8778959-B2 AZA-bridged ring-fused indoles and indolines ABBVIE INC. (US) 2014-07-15 US disclosed