SCHEMBL4010761

SCHEMBL4010761

CCCOc1ccccc1CC=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 3/20 0.51
MAPT P10636 3/20 0.51
NPSR1 Q6W5P4 1/20 0.51
ATM Q13315 2/20 0.46
HPGD P15428 3/20 0.45
ALDH1A1 P00352 3/20 0.44
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
BCHE P06276 1/20 0.43
ACHE P22303 1/20 0.43
KDM4E B2RXH2 3/20 0.43
LMNA P02545 1/20 0.41
PKM P14618 1/20 0.41
NLRP1 Q9C000 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
KCNH2 Q12809 1/20 0.41

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
SCHEMBL4706175 0.98 L3MBTL1 (0.50) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL4771965 0.90 MAPT (0.49) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL9260435 0.88 MAPT (0.51) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL7295184 0.88 L3MBTL1 (0.47) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL11738781 0.88 MAPT (0.51) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL2556550 0.85 L3MBTL1 (0.59) L3MBTL1MAPTNPSR1ATMALDH1A1
SCHEMBL4015695 0.84 KDM4E (0.51) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL910858 0.83 L3MBTL1 (0.49) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL5420692 0.83 L3MBTL1 (0.71) L3MBTL1MAPTNPSR1ATMHPGD
SCHEMBL8077527 0.82 ALDH1A1 (0.57) L3MBTL1MAPTNPSR1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2074114-A1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS Exelixis, Inc. (US) 2009-07-01 EP disclosed
WO-2008143759-A1 PYRIMIDINONES AS CASEIN KINASE II (CK2) MODULATORS EXELIXIS, INC. (US) 2008-11-27 WO disclosed
EP-1286997-A1 6-PHENYLPYRROLOPYRIMIDINEDIONE DERIVATIVES Almirall Prodesfarma, S.A. (ES) 2003-03-05 EP disclosed
WO-2001094350-A1 6-PHENYLPYRROLOPYRIMIDINEDIONE DERIVATIVES ALMIRALL PRODESFARMA S.A. (ES) 2001-12-13 WO disclosed