SCHEMBL7345347

SCHEMBL7345347

CC(C)(C)OC(=O)CN1CCC(N2CCN(c3ccc(C(=N)N)cc3)CC2)CC1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 10/20 0.71
ITGA2B P08514 10/20 0.71
ALOX15 P16050 1/20 0.70
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
F2 P00734 2/20 0.46
PRSS1 P07477 2/20 0.46
PRSS2 P07478 2/20 0.46
PRSS3 P35030 2/20 0.46
TMPRSS6 Q8IU80 2/20 0.46
ST14 Q9Y5Y6 2/20 0.46
GPR119 Q8TDV5 2/20 0.44
GRIN2D O15399 1/20 0.43
GRIN3B O60391 1/20 0.43
GRIN1 Q05586 1/20 0.43
GRIN2A Q12879 1/20 0.43
GRIN2B Q13224 1/20 0.43
GRIN2C Q14957 1/20 0.43
GRIN3A Q8TCU5 1/20 0.43
KDM4E B2RXH2 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
SCHEMBL7337291 0.90 ITGB3 (0.56) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7338384 0.88 ITGB3 (0.54) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7338379 0.88 ITGB3 (0.54) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7343054 0.87 ITGB3 (0.53) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7344477 0.86 ITGB3 (0.72) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7342517 0.86 ITGB3 (0.53) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7353169 0.86 ITGB3 (0.53) ITGB3ITGA2BALOX15F2PRSS1
SCHEMBL7343244 0.85 ITGB3 (0.51) ITGB3ITGA2BALOX15F2KDM4E
SCHEMBL7337996 0.85 ITGB3 (0.52) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7345105 0.85 ITGB3 (0.52) ITGB3ITGA2BALOX15KMT2AMEN1

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