SCHEMBL28031159

SCHEMBL28031159

CP(=O)(O)Oc1nc2cc(C(F)(F)F)ccc2c2ccccc12

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.38
▸ MAT2A P31153 2/20 0.37
▸ F7 P08709 1/20 0.37
▸ F3 P13726 1/20 0.37
▸ ACP3 P15309 2/20 0.36
▸ PARP1 P09874 2/20 0.36
▸ C1R P00736 2/20 0.36
▸ CTSD P07339 1/20 0.36
▸ KIF11 P52732 2/20 0.36
▸ NCS1 P62166 1/20 0.36
▸ ESR1 P03372 1/20 0.35
▸ DHODH Q02127 1/20 0.35
▸ L3MBTL1 Q9Y468 1/20 0.35
▸ PTPN1 P18031 2/20 0.35

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
SCHEMBL28031746 0.91 MAT2A (0.39) MAT2AACP3KIF11ESR1DHODH
SCHEMBL28031157 0.90 MAT2A (0.39) KDM4EMAT2AF7F3PARP1
SCHEMBL28031743 0.81 MAT2A (0.40) MAT2AKIF11ESR1DHODH
SCHEMBL28822266 0.81 GPR3 (0.47) KDM4EPARP1L3MBTL1
SCHEMBL28031751 0.77 GPR3 (0.38) KDM4EDHODHL3MBTL1
SCHEMBL28031130 0.75 DHODH (0.39) DHODH
SCHEMBL28031135 0.75 GPR3 (0.42) KDM4EL3MBTL1
SCHEMBL28031124 0.74 DHODH (0.39) KDM4EACP3PARP1DHODH
SCHEMBL28031691 0.74 KDM4E (0.41) KDM4EDHODHL3MBTL1
SCHEMBL28031125 0.73 KDM4E (0.44) KDM4E

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
CN-104844651-A Method for preparing six fluorine phosphonic acid ester base fe organism derivatives UNIV LUOYANG NORMAL 2015-08-19 — — CN disclosed
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