SCHEMBL13634289

SCHEMBL13634289

CCCN1CCC(c2nc(CC)cs2)CC1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 11/20 0.46
SLC6A4 P31645 5/20 0.46
ALDH1A1 P00352 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTR2A P28223 1/20 0.41
HRH1 P35367 1/20 0.41

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
SCHEMBL13634287 0.86 ERBB2 (0.39) DRD2ALDH1A1SMN1; SMN2HTR2AHRH1
SCHEMBL12387815 0.82 SLC6A3 (0.47) DRD2ALDH1A1SMN1; SMN2HTR2AHRH1
SCHEMBL13162593 0.78 DRD2 (0.44) DRD2SLC6A4ALDH1A1SMN1; SMN2
SCHEMBL12036182 0.77 BAZ2A (0.49)
SCHEMBL1364634 0.76 SLC6A3 (0.40) DRD2ALDH1A1SMN1; SMN2HTR2A
SCHEMBL13634290 0.76 BAZ2A (0.41) SMN1; SMN2
SCHEMBL13162290 0.76 DRD2 (0.41) DRD2SLC6A4ALDH1A1SMN1; SMN2
SCHEMBL12049941 0.75 DRD2 (0.40) DRD2ALDH1A1SMN1; SMN2HTR2AHRH1
SCHEMBL16603219 0.75 SLC6A3 (0.39) DRD2SMN1; SMN2HTR2A
SCHEMBL12036204 0.74 GPR119 (0.61)

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
US-8304547-B2 Azolecarboxamide compound or salt thereof ASTELLAS PHARMA INC. (JP) 2012-11-06 US disclosed