SCHEMBL28818009

SCHEMBL28818009

O=C(O)Nn1cc(F)cnc1=O

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ AGBL2 Q5U5Z8 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.33
▸ ALDH1A1 P00352 3/20 0.32
▸ HPGD P15428 2/20 0.32
▸ ATR Q13535 3/20 0.32
▸ NPC1 O15118 2/20 0.31
▸ RAB9A P51151 2/20 0.31
▸ GRM5 P41594 1/20 0.31
▸ KAT6A Q92794 2/20 0.30
▸ P4HTM Q9NXG6 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ PKM P14618 1/20 0.30
▸ GPR139 Q6DWJ6 1/20 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
SCHEMBL1225207 0.72 AGBL2 (0.33) AGBL2KDM4E
SCHEMBL11167289 0.68 ALDH1A1 (0.39) AGBL2KDM4EALDH1A1HPGD
SCHEMBL10912828 0.68 SCN4A (0.32) AGBL2GRM5GPR139
SCHEMBL13341567 0.67 AGBL2 (0.32) AGBL2
SCHEMBL11174630 0.65 — —
SCHEMBL309283 0.61 KDM4E (0.43) KDM4EALDH1A1ATR
SCHEMBL15348810 0.60 KDM4E (0.54) KDM4ENPC1RAB9AGRM5SMN1; SMN2
SCHEMBL21067103 0.60 AGBL2 (0.40) AGBL2ALDH1A1NPC1RAB9AP4HTM
SCHEMBL22834990 0.60 ATR (0.41) ATR
SCHEMBL308924 0.60 KDM4E (0.42) KDM4EALDH1A1

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-102548979-B 5-fluoro-2-oxopyrimidine- 1(2h)-carboxylate derivatives DOW AGROSCIENCES LLC 2015-05-13 — — CN disclosed
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