SCHEMBL3719632

SCHEMBL3719632

O=C(O)c1cncc(-c2ccc(-c3ccccc3)cc2F)c1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 3/20 0.52
MKNK2 Q9HBH9 3/20 0.52
AXL P30530 1/20 0.47
KMO O15229 2/20 0.47
HCAR2 Q8TDS4 1/20 0.46
CYP11B2 P19099 2/20 0.46
CYP11B1 P15538 1/20 0.46
DHODH Q02127 2/20 0.45
KAT6A Q92794 1/20 0.45
KDM4E B2RXH2 1/20 0.45
LMNA P02545 1/20 0.45
HSD17B10 Q99714 1/20 0.45
ABCB1 P08183 1/20 0.45
ADH5 P11766 1/20 0.45
CTSA P10619 1/20 0.44
AKR1C3 P42330 2/20 0.44
AKR1C2 P52895 2/20 0.44

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
SCHEMBL3711194 0.87 HDAC1 (0.56) KAT6AABCB1CTSA
SCHEMBL3715166 0.85 EGFR (0.53) AXLCYP11B2CYP11B1KAT6AABCB1
SCHEMBL2515900 0.85 CTSA (0.53) MKNK1MKNK2KMOHCAR2CYP11B2
SCHEMBL2259194 0.84 HCAR2 (0.54) MKNK1MKNK2AXLKMOHCAR2
SCHEMBL2262047 0.81 KDM1A (0.59) MKNK1MKNK2HCAR2DHODHKDM4E
SCHEMBL569730 0.81 MKNK1 (0.69) MKNK1MKNK2KMOHCAR2DHODH
SCHEMBL2900222 0.77 MKNK1 (0.68) MKNK1MKNK2HCAR2KDM4ELMNA
SCHEMBL31475536 0.76 HCAR2 (0.56) MKNK1MKNK2AXLKMOHCAR2
SCHEMBL25544943 0.76 HCAR2 (0.56) MKNK1MKNK2AXLKMOHCAR2
SCHEMBL21652631 0.74 MKNK1 (0.51) MKNK1MKNK2KMOHCAR2KDM4E

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
WO-2010100475-A1 HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2010-09-10 WO disclosed
WO-2010100475-A1 HYDROXAMIC ACID DERIVATIVES AS GRAM-NEGATIVE ANTIBACTERIAL AGENTS ASTRAZENECA AB (SE) 2010-09-10 WO disclosed