SCHEMBL4082722

SCHEMBL4082722

CCCOC(=O)c1cc2c(o1)c(NC(=O)c1ccc(CN3CCN(C)CC3)cc1)nn2C(=O)OCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
TSHR P16473 1/20 0.43
MAPK1 P28482 1/20 0.43
STAT3 P40763 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
BTK Q06187 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
KDR P35968 1/20 0.42
IKBKE Q14164 4/20 0.41
L3MBTL1 Q9Y468 1/20 0.40
MAPK14 Q16539 3/20 0.40
LCK P06239 2/20 0.40
CSF1R P07333 2/20 0.40
HDAC1 Q13547 1/20 0.40
TBK1 Q9UHD2 3/20 0.39
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
TNF P01375 1/20 0.39

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
SCHEMBL4086291 0.94 MAPK1 (0.44) RAB9ALMNAMAPTTSHRMAPK1
SCHEMBL4083518 0.94 LMNA (0.44) RAB9ALMNAMAPTTSHRMAPK1
SCHEMBL4093445 0.93 LMNA (0.44) RAB9ALMNAMAPTTSHRMAPK1
SCHEMBL4088668 0.92 SMN1; SMN2 (0.54) RAB9ALMNAMAPTTSHRMAPK1
SCHEMBL4083005 0.89 MAPT (0.44) RAB9AMAPTTSHRSMN1; SMN2BTK
SCHEMBL4088637 0.86 ALDH1A1 (0.43) RAB9ALMNAMAPTTSHRSMN1; SMN2
SCHEMBL4083876 0.85 KIT (0.45) KDRMAPK14LCKMEN1KMT2A
SCHEMBL4091779 0.85 LMNA (0.44) RAB9ALMNAMAPTSMN1; SMN2KMT2A
SCHEMBL4078418 0.84 HTT (0.43) RAB9ALMNAMAPTTSHRSMN1; SMN2
SCHEMBL1434223 0.84 ABL1 (0.45) BTKHDAC6KDRMAPK14HDAC1

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-2058315-A1 1H-Furo[3,2-C]Pyrazoles active as aurora kinase inhibitors Nerviano Medical Sciences S.r.l. (IT) 2009-05-13 EP claimed
EP-2058315-A1 1H-Furo[3,2-C]Pyrazoles active as aurora kinase inhibitors Nerviano Medical Sciences S.r.l. (IT) 2009-05-13 EP disclosed