SCHEMBL4086303

SCHEMBL4086303

O=C(O)c1cc2[nH]nc(NC(=O)c3ccco3)c2o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.49
PKM P14618 2/20 0.48
GAA P10253 1/20 0.48
APOBEC3G Q9HC16 1/20 0.48
RAB9A P51151 6/20 0.46
TDP1 Q9NUW8 2/20 0.44
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.43
ATM Q13315 1/20 0.43
CSNK2A2 P19784 1/20 0.43
CSNK2A1 P68400 1/20 0.43
NPC1 O15118 4/20 0.43
KCNK3 O14649 1/20 0.42
KCNK9 Q9NPC2 1/20 0.42
KDM4E B2RXH2 2/20 0.42
TSHR P16473 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
KMT2A Q03164 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL4083540 0.84 FGFR1 (0.50) MAPK1RAB9ACSNK2A1NPC1KMT2A
SCHEMBL4086452 0.82 MAPK1 (0.46) MAPK1PKMGAAAPOBEC3GRAB9A
SCHEMBL4083945 0.81 MAPK1 (0.45) MAPK1PKMGAAAPOBEC3GRAB9A
SCHEMBL4087457 0.81 KLK7 (0.47) PKMGAARAB9ATDP1TP53
SCHEMBL4078720 0.80 SMN1; SMN2 (0.46) MAPK1PKMRAB9ATP53MAPT
SCHEMBL4083484 0.80 SMN1; SMN2 (0.51) MAPK1PKMRAB9ATDP1TP53
SCHEMBL4078387 0.80 MAPK1 (0.48) MAPK1PKMRAB9ATDP1NPC1
SCHEMBL4078618 0.80 CDK7 (0.35) MAPK1PKMGAARAB9AMAPT
SCHEMBL4088586 0.80 KCNK3 (0.42) RAB9AKCNK3KCNK9ADORA3ADORA2A
SCHEMBL4091695 0.79 MAPK1 (0.45) MAPK1PKMGAAAPOBEC3GRAB9A

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