SCHEMBL2591834

SCHEMBL2591834

CCOC(=O)C1=CN=CC(c2ccc(F)cc2)C1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRA2 P47869 1/20 0.43
GABRB2 P47870 1/20 0.43
LMNA P02545 3/20 0.42
POLB P06746 2/20 0.42
TRPM8 Q7Z2W7 1/20 0.41
ALDH1A1 P00352 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
MAPT P10636 5/20 0.40
NPSR1 Q6W5P4 3/20 0.40
NPC1 O15118 3/20 0.40
RAB9A P51151 3/20 0.40
KDM4E B2RXH2 3/20 0.40
HPGD P15428 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
THRB P10828 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
HTT P42858 1/20 0.40
PKM P14618 1/20 0.40

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
SCHEMBL319740 0.87 MAPT (0.44) LMNAPOLBALDH1A1MAPTKDM4E
SCHEMBL1559540 0.77 ACHE (0.41) GABRA2GABRB2LMNAPOLBTRPM8
SCHEMBL6883352 0.75 POLB (0.38) LMNAPOLBALDH1A1MAPTNPSR1
SCHEMBL2648346 0.72 ALDH1A1 (0.37) LMNAPOLBALDH1A1L3MBTL1MAPT
SCHEMBL27992858 0.68 GABRA2 (0.47) GABRA2GABRB2LMNATRPM8ALDH1A1
SCHEMBL4570567 0.65 KMT2A (0.75) LMNAPOLBALDH1A1MAPTNPSR1
SCHEMBL62862 0.65 KMT2A (0.75) LMNAPOLBALDH1A1MAPTNPSR1
SCHEMBL7365076 0.65 KMT2A (0.69) LMNAPOLBTRPM8ALDH1A1MAPT
SCHEMBL3029762 0.64 KDM4E (0.76) LMNAALDH1A1MAPTRAB9AKDM4E
SCHEMBL1225913 0.64 CA12 (0.51) LMNAPOLBALDH1A1L3MBTL1MAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2563773-A1 PYRIDONE AMIDES AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITES Deciphera Pharmaceuticals, LLC (US) 2013-03-06 EP disclosed
WO-2011139891-A1 PYRIDONE AMIDES AND ANALOGS EXHIBITING ANTI-CANCER AND ANTI-PROLIFERATIVE ACTIVITES DECIPHERA PHARMACEUTICALS, LLC (US) 2011-11-10 WO disclosed
EP-2235001-A1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER Bristol-Myers Squibb Company (US) 2010-10-06 EP disclosed
EP-2235002-A1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER Bristol-Myers Squibb Company (US) 2010-10-06 EP disclosed
WO-2009094417-A1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER BRISTOL-MYERS SQUIBB COMPANY (US) 2009-07-30 WO disclosed
WO-2009094427-A1 4-PYRIDINONE COMPOUNDS AND THEIR USE FOR CANCER BRISTOL-MYERS SQUIBB COMPANY (US) 2009-07-30 WO disclosed