SCHEMBL5282842

SCHEMBL5282842

COC(=O)Oc1c(C)cccc1-c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.47
FGFR1 P11362 2/20 0.46
FGFR2 P21802 2/20 0.46
FGFR4 P22455 2/20 0.46
FGFR3 P22607 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
KDM4E B2RXH2 3/20 0.42
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
SRC P12931 1/20 0.42
ALDH1A1 P00352 2/20 0.42
NPC1 O15118 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42
SCN8A Q9UQD0 1/20 0.42
HTT P42858 1/20 0.41
BACE1 P56817 1/20 0.41
CTSA P10619 2/20 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
SCHEMBL17697649 0.90 BACE1 (0.49) L3MBTL1FGFR1FGFR2FGFR4FGFR3
SCHEMBL17720733 0.87 L3MBTL1 (0.50) L3MBTL1FGFR1FGFR2FGFR4FGFR3
SCHEMBL180120 0.85 SMN1; SMN2 (0.47) L3MBTL1FGFR1FGFR2FGFR4FGFR3
SCHEMBL9378330 0.84 HPGD (0.46) FGFR1FGFR2FGFR4FGFR3KDM4E
SCHEMBL6676838 0.83 BACE1 (0.45) SMN1; SMN2KMT2AMEN1MAPTRAB9A
SCHEMBL25257372 0.82 L3MBTL1 (0.55) L3MBTL1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL17697668 0.81 L3MBTL1 (0.43) L3MBTL1SMN1; SMN2KMT2AALDH1A1MAPT
SCHEMBL17720768 0.79 SMN1; SMN2 (0.47) L3MBTL1FGFR1FGFR2FGFR4FGFR3
SCHEMBL17703419 0.79 L3MBTL1 (0.46) L3MBTL1SMN1; SMN2KDM4EHPGDHSD17B10
SCHEMBL17720739 0.79 PDE4B (0.44) FGFR1FGFR2FGFR4FGFR3KDM4E

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-1866280-A1 ACYL HYDRAZIDES AS KINASE INHIBITORS, IN PARTICULAR FOR SGK Merck Patent GmbH (DE) 2007-12-19 EP disclosed
WO-2006105850-A1 ACYL HYDRAZIDES AS KINASE INHIBITORS, IN PARTICULAR FOR SGK MERCK PATENT GMBH (DE) 2006-10-12 WO disclosed