SCHEMBL14835600

SCHEMBL14835600

CC(C)(C)OC(=O)N1CCO[C@@H](CCCOS(=O)(=O)c2ccc(Br)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 3/20 0.45
GPR119 Q8TDV5 13/20 0.45
MMP1 P03956 2/20 0.39
MMP9 P14780 2/20 0.39
MMP3 P08254 1/20 0.39
MMP7 P09237 1/20 0.39
RORC P51449 1/20 0.38
MMP13 P45452 1/20 0.38
P2RX7 Q99572 1/20 0.38
ERBB2 P04626 1/20 0.37
EPHB4 P54760 1/20 0.37

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
SCHEMBL14835601 1.00 EPHA2 (0.45) EPHA2GPR119MMP1MMP9MMP3
SCHEMBL14835647 1.00 EPHA2 (0.45) EPHA2GPR119MMP1MMP9MMP3
SCHEMBL12527484 0.85 KMT2A (0.43) EPHA2GPR119MMP1MMP9MMP3
SCHEMBL8891747 0.82 GPR119 (0.42) EPHA2GPR119
SCHEMBL20913869 0.82 GPR119 (0.42) EPHA2GPR119
SCHEMBL18689807 0.82 GPR119 (0.42) EPHA2GPR119
SCHEMBL31494035 0.81 EPHA2 (0.42) EPHA2GPR119MMP1MMP9MMP3
SCHEMBL617822 0.79 PDK1 (0.45) EPHA2GPR119MMP1MMP9MMP3
SCHEMBL617821 0.79 PDK1 (0.45) EPHA2GPR119MMP1MMP9MMP3
SCHEMBL618014 0.79 PDK1 (0.45) EPHA2GPR119MMP1MMP9MMP3

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-2576510-A1 PIPERIDINONE DERIVATIVES AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER Amgen Inc. (US) 2013-04-10 EP disclosed
WO-2011153509-A1 PIPERIDINONE DERIVATIVES AS MDM2 INHIBITORS FOR THE TREATMENT OF CANCER AMGEN INC. (US) 2011-12-08 WO disclosed