SCHEMBL7338598

SCHEMBL7338598

CC1CN(CC(=O)OC(C)(C)C)CCC1N1CCN(c2ccc(/C(N)=N\O)cc2)CC1

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 4/20 0.40
ITGB3 P05106 1/20 0.40
ITGA2B P08514 1/20 0.40
ALOX15 P16050 1/20 0.39
HTT P42858 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
ALDH1A1 P00352 1/20 0.36
HPGD P15428 1/20 0.36
MAPK1 P28482 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
CXCR3 P49682 1/20 0.35
CYP2C19 P33261 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLC18A3 Q16572 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
SCHEMBL7338609 1.00 GPR119 (0.40) GPR119ITGB3ITGA2BALOX15HTT
SCHEMBL7338620 1.00 GPR119 (0.40) GPR119ITGB3ITGA2BALOX15HTT
SCHEMBL7338384 0.87 ITGB3 (0.54) GPR119ITGB3ITGA2BALOX15HTT
SCHEMBL7338379 0.87 ITGB3 (0.54) GPR119ITGB3ITGA2BALOX15HTT
SCHEMBL7345216 0.84 AR (0.41) GPR119MEN1
SCHEMBL7080070 0.75 ITGB3 (0.69) ITGB3ITGA2BALOX15
SCHEMBL7346439 0.75 ITGB3 (0.69) ITGB3ITGA2BALOX15
Iodide SCHEMBL8688342 0.75 ITGB3 (0.46) GPR119ITGB3ITGA2BALOX15MEN1
SCHEMBL7337291 0.75 ITGB3 (0.56) GPR119ITGB3ITGA2BALOX15HTT
SCHEMBL7345347 0.75 ITGB3 (0.71) GPR119ITGB3ITGA2BALOX15MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0612313-A1 PIPERIDINE ACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-08-31 EP claimed
WO-1993010091-A2 PIPERIDINE ACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-05-27 WO claimed
EP-0542363-A2 Piperidineacetic acid derivatives as inhibitors of fibrinogen-dependent blood platelet aggregation GLAXO GROUP LIMITED (GB) 1993-05-19 EP claimed
EP-0612313-A1 PIPERIDINE ACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-08-31 EP disclosed
WO-1993010091-A2 PIPERIDINE ACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-05-27 WO disclosed
EP-0542363-A2 Piperidineacetic acid derivatives as inhibitors of fibrinogen-dependent blood platelet aggregation GLAXO GROUP LIMITED (GB) 1993-05-19 EP disclosed