SCHEMBL7009795

SCHEMBL7009795

CCOC(=O)CC(=O)c1cc(C)c(F)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
GAA P10253 2/20 0.41
MGLL Q99685 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2C19 P33261 1/20 0.40
HPGD P15428 2/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
MGAM O43451 1/20 0.40
SI P14410 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
MIF P14174 1/20 0.40
POLB P06746 1/20 0.38
APEX1 P27695 1/20 0.38
BAZ2B Q9UIF8 1/20 0.38

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
SCHEMBL1241168 0.91 GAA (0.49) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL7162469 0.88 MEN1 (0.41) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL4714980 0.87 TDP1 (0.42) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL8183324 0.86 MEN1 (0.44) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL30680417 0.84 ALDH1A1 (0.42) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL10628831 0.83 ALDH1A1 (0.44) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL1301604 0.81 LMNA (0.43) MEN1KMT2AKDM4EALDH1A1GAA
SCHEMBL30181504 0.81 MEN1 (0.42) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL29007819 0.81 MEN1 (0.42) TDP1MEN1KMT2AKDM4EALDH1A1
SCHEMBL3412192 0.79 TDP1 (0.47) TDP1MEN1KMT2AKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0945435-B1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMA CO LTD (JP) 2003-08-13 EP disclosed
US-6136823-A BACTERICIDES OR VIRICIDES WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 2000-10-24 US disclosed
EP-0945435-A1 NOVEL PYRIDONECARBOXYLIC ACID DERIVATIVES OR SALTS THEREOF AND DRUGS CONTAINING THE SAME AS THE ACTIVE INGREDIENT WAKUNAGA PHARMACEUTICAL CO., LTD. (JP) 1999-09-29 EP disclosed