SCHEMBL8908002

SCHEMBL8908002

COc1ccc(C(=O)Nc2ccccc2C(N)=NOC(C)=O)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.48
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
AHR P35869 1/20 0.47
HDAC1 Q13547 2/20 0.47
NNMT P40261 1/20 0.47
P4HTM Q9NXG6 1/20 0.45
CHEK1 O14757 1/20 0.44
PIM1 P11309 1/20 0.44
MAPK8 P45983 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
RORC P51449 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
ABCG2 Q9UNQ0 2/20 0.42
ABCB1 P08183 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
GAA P10253 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
SCHEMBL8907998 1.00 F10 (0.48) F10MEN1KMT2AAHRHDAC1
SCHEMBL5584774 0.82 MEN1 (0.53) F10MEN1KMT2AAHRHDAC1
SCHEMBL8554348 0.81 TSHR (0.61) MEN1KMT2AAHRHDAC1P4HTM
SCHEMBL8564208 0.81 CHEK1 (0.61) MEN1KMT2AAHRHDAC1P4HTM
SCHEMBL8560123 0.80 CHEK1 (0.60) MEN1KMT2AAHRHDAC1P4HTM
SCHEMBL8890707 0.79 CYP1A2 (0.62) F10MEN1KMT2AHDAC1NPC1
SCHEMBL8890716 0.79 CYP1A2 (0.62) F10MEN1KMT2AHDAC1NPC1
SCHEMBL8560118 0.79 MEN1 (0.53) F10MEN1KMT2AAHRHDAC1
SCHEMBL5584408 0.76 MEN1 (0.50) F10MEN1KMT2AAHRHDAC1
SCHEMBL5584406 0.76 PKM (0.52) MEN1KMT2AAHRHDAC1P4HTM

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-1997030047-A1 FUNGICIDAL 1,2,4-OXADIAZOLES AND ANALOGUES AGREVO UK LIMITED (GB) 1997-08-21 WO disclosed