SCHEMBL4090157

SCHEMBL4090157

CC(=O)OC(C)c1cc(F)ccc1/C=N/O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.35
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ LMNA P02545 1/20 0.35
▸ POLB P06746 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ AMY1A P0DUB6 1/20 0.33
▸ MPO P05164 1/20 0.32
▸ RECQL P46063 1/20 0.32
▸ USP2 O75604 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ HPGD P15428 3/20 0.31
▸ TSHR P16473 2/20 0.31
▸ GRIN2D O15399 1/20 0.31
▸ GRIN3B O60391 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2A Q12879 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ GRIN2C Q14957 1/20 0.31

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
SCHEMBL4092075 0.81 USP2 (0.40) ALDH1A1L3MBTL1LMNAMAPTUSP2
SCHEMBL17380950 0.77 CES2 (0.46) POLBRECQLKMT2A
SCHEMBL22241276 0.77 CES2 (0.46) POLBRECQLKMT2A
SCHEMBL2718388 0.76 POLB (0.32) ALDH1A1L3MBTL1LMNAPOLBMAPT
SCHEMBL2718384 0.76 POLB (0.32) ALDH1A1L3MBTL1LMNAPOLBMAPT
SCHEMBL31473198 0.75 CES2 (0.34) ALDH1A1L3MBTL1LMNAPOLBMAPT
SCHEMBL22201767 0.67 HDAC3 (0.41) ALDH1A1MAPTKDM4ETSHR
SCHEMBL17503145 0.67 HPGD (0.43) ALDH1A1L3MBTL1LMNAPOLBMAPT
SCHEMBL17539208 0.67 HPGD (0.43) ALDH1A1L3MBTL1LMNAPOLBMAPT
SCHEMBL17503146 0.67 HPGD (0.43) ALDH1A1L3MBTL1LMNAPOLBMAPT

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-2012061696-A1 5 -CYANO-4, 6 -DIAMINOPYRIMIDINE OR 6 -AMINOPURINE DERIVATIVES AS PI3K- DELTA INHIBITORS AMGEN INC. (US) 2012-05-10 — — WO disclosed
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