SCHEMBL3667050

SCHEMBL3667050

CC[C@H](CN(C)CCOC)n1cnc2ncc(Cl)cc21

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 1/20 0.33
F10 P00742 1/20 0.32
CRHR1 P34998 2/20 0.31
SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL3669348 0.80 CRHR1 (0.31) PIK3CDF10CRHR1
SCHEMBL14763123 0.70 MET (0.38)
SCHEMBL3675921 0.67 HRH4 (0.31)
SCHEMBL16302883 0.64 HPGD (0.36)
SCHEMBL3669422 0.64 CRHR1 (0.33) CRHR1
SCHEMBL3668456 0.62 HRH4 (0.33)
SCHEMBL3670855 0.61 HRH4 (0.33)
SCHEMBL3771728 0.60 TSHR (0.32)
SCHEMBL3666328 0.59 BACE1 (0.36)
SCHEMBL25304003 0.58 AOC3 (0.49) PIK3CD

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
EP-2139478-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS Cytokinetics, Incorporated (US) 2010-01-06 EP claimed
WO-2008121333-A1 CERTAIN CHEMICAL ENTITIES, COMPOSITIONS AND METHODS CYTOKINETICS, INCORPORATED (US) 2008-10-09 WO claimed