SCHEMBL13459727

SCHEMBL13459727

CCCN(CCC)c1c(Cl)ccc2nc(Cl)n(C)c12

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CRHR1 P34998 19/20 0.40
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL13459227 0.77 CRHR1 (0.54) CRHR1
SCHEMBL3287091 0.75 CRHR1 (0.41) CRHR1SMN1; SMN2
SCHEMBL13459230 0.75 CRHR1 (0.52) CRHR1
SCHEMBL13459552 0.73 CRHR1 (0.43) CRHR1SMN1; SMN2
SCHEMBL13459232 0.71 CRHR1 (0.76) CRHR1
SCHEMBL13459224 0.69 DPP4 (0.44) CRHR1SMN1; SMN2
SCHEMBL13459233 0.67 CRHR1 (0.40) CRHR1SMN1; SMN2
SCHEMBL3285073 0.67 CRHR1 (0.42) CRHR1
SCHEMBL2082782 0.62 SMN1; SMN2 (0.44) CRHR1SMN1; SMN2
SCHEMBL13199946 0.60 SMN1; SMN2 (0.46) SMN1; SMN2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010032461-A1 NITROGEN-CONTAINING FUSED RING COMPOUND 武田薬品工業株式会社 (JP) 2010-03-25 WO disclosed