SCHEMBL7714519

SCHEMBL7714519

CCOC(=O)C1CCCc2ccccc2C1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.52
MAPT P10636 5/20 0.52
HPGD P15428 5/20 0.52
KMT2A Q03164 5/20 0.52
MEN1 O00255 4/20 0.52
KDM4E B2RXH2 3/20 0.52
HSD17B10 Q99714 2/20 0.52
GAA P10253 1/20 0.52
MAPK1 P28482 1/20 0.47
ATM Q13315 1/20 0.47
LMNA P02545 3/20 0.46
ACHE P22303 1/20 0.46
PTGS2 P35354 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.44
POLB P06746 1/20 0.43
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TLR4 O00206 1/20 0.42

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
SCHEMBL947365 0.92 ALDH1A1 (0.55) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL29683518 0.92 ALDH1A1 (0.55) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL2166539 0.85 NPC1 (0.44) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL31460799 0.83 MAPT (0.70) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL490810 0.83 MAPT (0.70) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL2115724 0.82 ALDH1A1 (0.51) ALDH1A1HPGDKMT2AMEN1KDM4E
SCHEMBL4875547 0.81 SMN1; SMN2 (0.43) ALDH1A1MAPTKDM4EHSD17B10MAPK1
SCHEMBL467497 0.79 ALDH1A1 (0.47) ALDH1A1MAPTHPGDKDM4EHSD17B10
SCHEMBL31650126 0.78 ACHE (0.51) ALDH1A1MAPTHPGDKMT2AMEN1
SCHEMBL1160244 0.78 ACHE (0.51) ALDH1A1MAPTHPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6369110-B1 PROPHYLACTIC AGENT FOR DISEASES CAUSED BY THE ACCELERATION OF THE SODIUM/PROTON EXCHANGE TRANSPORT SYSTEM SUMITOMO PHARMACEUTICALS COMPANY (JP) 2002-04-09 US disclosed
EP-1083166-A1 NOVEL SUBSTITUTED GUANIDINE DERIVATIVES AND PROCESS FOR PRODUCING THE SAME SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 2001-03-14 EP disclosed
EP-0123750-B1 Condensed amino pyrimidinones and their use in the treatment and prophylaxis of viral infections BIOMEASURE INC (US) 1995-04-26 EP disclosed
US-4625026-A 2-amino-4-oxo-tricyclicpyrimidines having antiviral activities against herpes simplex virus type II infections BIOMEASURE, INC. (US) 1986-11-25 US disclosed
EP-0123750-A1 Condensed amino pyrimidinones and their use in the treatment and prophylaxis of viral infections BIOMEASURE, INC. (US) 1984-11-07 EP disclosed