SCHEMBL7344717

SCHEMBL7344717

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

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
ALOX15 P16050 1/20 0.46
KMT2A Q03164 2/20 0.46
POLB P06746 1/20 0.45
MEN1 O00255 1/20 0.43
AR P10275 1/20 0.42
CHRM4 P08173 2/20 0.41
CTSS P25774 1/20 0.41
CTSK P43235 1/20 0.41
USP5 P45974 1/20 0.41
USP14 P54578 1/20 0.41
USP7 Q93009 1/20 0.41
HRH3 Q9Y5N1 1/20 0.41
DPP4 P27487 1/20 0.41
GPR119 Q8TDV5 2/20 0.40
IRAK4 Q9NWZ3 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
SCHEMBL7337986 0.88 GPR119 (0.50) POLBARCHRM4USP5USP14
SCHEMBL7345216 0.86 AR (0.41) POLBMEN1ARCHRM4CTSS
SCHEMBL21876880 0.86 ITGB3 (0.49) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7337695 0.85 AR (0.44) ARHRH3GPR119IRAK4
SCHEMBL7435316 0.84 GPR119 (0.57) ARGPR119IRAK4
SCHEMBL7297025 0.82 KMT2A (0.41) KMT2AMEN1ARCHRM4CTSS
SCHEMBL7338384 0.82 ITGB3 (0.54) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7338379 0.82 ITGB3 (0.54) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7337291 0.82 ITGB3 (0.56) ITGB3ITGA2BALOX15KMT2AMEN1
SCHEMBL7345347 0.82 ITGB3 (0.71) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0623120-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1994-11-09 EP disclosed
WO-1993014077-A1 PIPERIDINEACETIC ACID DERIVATIVES AS INHIBITORS OF FIBRINOGEN-DEPENDENT BLOOD PLATELET AGGREGATION GLAXO GROUP LIMITED (GB) 1993-07-22 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