SCHEMBL2640646

SCHEMBL2640646

C[C@H]1CCCN1c1ccc(C(N)=O)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LCK P06239 1/20 0.48
JAK3 P52333 1/20 0.48
GFER P55789 1/20 0.48
GAA P10253 1/20 0.45
HPGD P15428 1/20 0.45
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
CHRNA7 P36544 1/20 0.42
CHRNA10 Q9GZZ6 1/20 0.42
CHRNA9 Q9UGM1 1/20 0.42
GPR119 Q8TDV5 1/20 0.42
LRRK2 Q5S007 1/20 0.41
PARP10 Q53GL7 1/20 0.41
USP2 O75604 1/20 0.41
PDK2 Q15119 1/20 0.40
SYK P43405 2/20 0.40
HRH3 Q9Y5N1 2/20 0.40
AR P10275 1/20 0.40
FFAR1 O14842 1/20 0.40
CA12 O43570 1/20 0.40

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
SCHEMBL6607096 0.78 ALDH1A1 (0.47) JAK3GFERGAAHPGDMAOA
SCHEMBL6698446 0.77 GFER (0.51) GFERHPGDCHRNA7CHRNA10CHRNA9
SCHEMBL27808167 0.77 NPC1 (0.54) GAAHPGDMAOAMAOB
SCHEMBL5631357 0.77 RAD52 (0.44) CHRNA7CHRNA10CHRNA9GPR119USP2
Hydrochloric Acid SCHEMBL6763531 0.76 ALDH1A1 (0.46) JAK3GFERGAAHPGDMAOA
SCHEMBL24824101 0.75 HRH3 (0.49) GFERHPGDMAOAMAOBPDK2
SCHEMBL18786266 0.75 HRH3 (0.49) GFERHPGDMAOAMAOBPDK2
SCHEMBL1729799 0.75 HRH3 (0.63) HRH3
SCHEMBL14941705 0.75 TRIM24 (0.52) GAAMAOAMAOBPDK2AR
SCHEMBL24681100 0.74 PSEN1 (0.45) HPGDMAOAMAOBPDK2AR

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-2569280-A1 SUBSTITUTED PHENYL CYCLOALKYL PYRROLIDINE (PIPERIDINE) SPIROLACTAMS AND AMIDES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2013-03-20 EP disclosed
WO-2011143150-A1 SUBSTITUTED PHENYL CYCLOALKYL PYRROLIDINE (PIPERIDINE) SPIROLACTAMS AND AMIDES, PREPARATION AND THERAPEUTIC USE THEREOF SANOFI (FR) 2011-11-17 WO disclosed