SCHEMBL8525765

SCHEMBL8525765

CCOC(=O)c1noc(C2CC2)c1C(=O)c1ccc(-n2cnc(C)n2)c(C)c1CC

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
GABRG2 P18507 5/20 0.33
GABRB3 P28472 5/20 0.33
GABRA5 P31644 5/20 0.33
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
USP2 O75604 1/20 0.32
MAPT P10636 1/20 0.32
TSHR P16473 1/20 0.32
KMT2A Q03164 1/20 0.32
HSD17B10 Q99714 1/20 0.32
RXFP1 Q9HBX9 1/20 0.31
HSP90AA1 P07900 1/20 0.31
HCRTR2 O43614 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HTR2C P28335 1/20 0.31
THRB P10828 1/20 0.31
GABRA1 P14867 2/20 0.30
GABRA3 P34903 2/20 0.30
GABRA2 P47869 2/20 0.30

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
SCHEMBL8525760 0.90 LMNA (0.33) LMNAGABRG2GABRB3GABRA5KDM4E
SCHEMBL8524884 0.86 LMNA (0.34) LMNAGABRG2GABRB3GABRA5KDM4E
SCHEMBL8494706 0.86 KDM4E (0.39) LMNAGABRG2GABRB3GABRA5KDM4E
SCHEMBL8491729 0.86 L3MBTL1 (0.35) LMNAGABRG2GABRB3GABRA5KDM4E
SCHEMBL8524560 0.86 HCRTR2 (0.42) LMNAGABRG2GABRB3GABRA5KDM4E
SCHEMBL8524835 0.85 HCRTR2 (0.34) LMNAKDM4EMEN1USP2MAPT
SCHEMBL8488625 0.83 NPC1 (0.40) LMNAGABRG2GABRB3GABRA5KDM4E
SCHEMBL8488620 0.80 NPC1 (0.35) LMNAKDM4EMEN1KMT2AHSD17B10
SCHEMBL8523977 0.79 NPC1 (0.36) LMNAKDM4EHSD17B10RXFP1HSP90AA1
SCHEMBL8491726 0.77 L3MBTL1 (0.35) LMNAGABRG2GABRB3GABRA5KDM4E

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1999003856-A1 4-BENZOYL-ISOXAZOLE- AND -PYRAZOLE DERIVATIVES AND 2-CYANO 1,3-DIONE DERIVATIVES AS HERBICIDES RHONE-POULENC AGRICULTURE LIMITED (GB) 1999-01-28 WO disclosed