SCHEMBL13634287

SCHEMBL13634287

CCc1csc(C2CCN(C)CC2)n1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 1/20 0.39
EPHA2 P29317 1/20 0.39
KDR P35968 1/20 0.39
EPHB4 P54760 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GPR119 Q8TDV5 5/20 0.39
SLC6A3 Q01959 2/20 0.38
DRD2 P14416 3/20 0.38
HTR2A P28223 3/20 0.38
CTSL P07711 1/20 0.35
CTSB P07858 1/20 0.35
CTSS P25774 1/20 0.35
HRH1 P35367 2/20 0.35
BAZ2A Q9UIF9 1/20 0.34
OGA O60502 1/20 0.33
PLG P00747 1/20 0.33

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
SCHEMBL13634289 0.86 DRD2 (0.46) ALDH1A1SMN1; SMN2DRD2HTR2AHRH1
SCHEMBL12387815 0.86 SLC6A3 (0.47) ALDH1A1SMN1; SMN2GPR119SLC6A3DRD2
SCHEMBL12049941 0.85 DRD2 (0.40) ERBB2EPHA2KDREPHB4ALDH1A1
SCHEMBL12036182 0.81 BAZ2A (0.49) GPR119SLC6A3BAZ2A
SCHEMBL1364634 0.80 SLC6A3 (0.40) ALDH1A1SMN1; SMN2GPR119SLC6A3DRD2
SCHEMBL13634290 0.80 BAZ2A (0.41) SMN1; SMN2GPR119SLC6A3BAZ2A
SCHEMBL16603219 0.79 SLC6A3 (0.39) SMN1; SMN2GPR119SLC6A3DRD2HTR2A
SCHEMBL14212538 0.78 OGA (0.49) ALDH1A1SMN1; SMN2CTSLCTSBCTSS
SCHEMBL12036204 0.78 GPR119 (0.61) GPR119
SCHEMBL14212541 0.77 ALDH1A1 (0.38) ERBB2EPHA2KDREPHB4ALDH1A1

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