SCHEMBL4089305

SCHEMBL4089305

Cc1ccc(C(=O)Nc2n[nH]c3cc(C(=O)O)oc23)s1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 11/20 0.42
RAB9A P51151 10/20 0.42
KMT2A Q03164 7/20 0.42
MEN1 O00255 5/20 0.42
SMN1; SMN2 Q16637 7/20 0.42
DAO P14920 1/20 0.40
POLB P06746 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 6/20 0.39
LMNA P02545 4/20 0.39
HPGD P15428 3/20 0.39
TP53 P04637 2/20 0.39
HSD17B10 Q99714 1/20 0.39
PARP1 P09874 1/20 0.39
KDM4E B2RXH2 3/20 0.38
MAPT P10636 3/20 0.38
NPSR1 Q6W5P4 2/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
USP2 O75604 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
SCHEMBL4086374 0.86 HPGD (0.43) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL4088880 0.84 AURKA (0.45) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL4087457 0.81 KLK7 (0.47) NPC1RAB9ASMN1; SMN2POLBTDP1
SCHEMBL4083484 0.80 SMN1; SMN2 (0.51) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL4083540 0.79 FGFR1 (0.50) NPC1RAB9AKMT2AMEN1HTT
SCHEMBL4088557 0.79 SMN1; SMN2 (0.48) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL4078720 0.78 SMN1; SMN2 (0.46) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL4088647 0.78 PKM (0.46) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL4088272 0.78 ALDH1A1 (0.40) SMN1; SMN2ALDH1A1LMNAHSD17B10MAPT
SCHEMBL4081816 0.78 MAPT (0.47) NPC1RAB9AKMT2AMEN1SMN1; SMN2

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