SCHEMBL7009112

SCHEMBL7009112

CCOC(=O)c1cn(-c2cc(NC(=O)OC(C)(C)C)c(F)c(F)c2F)c2c(Cl)c(F)c(F)cc2c1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.46
HTT P42858 1/20 0.40
KDM4E B2RXH2 3/20 0.38
HPGD P15428 3/20 0.38
ALDH1A1 P00352 3/20 0.38
HSD17B10 Q99714 2/20 0.38
KMT2A Q03164 2/20 0.37
ADRB2 P07550 1/20 0.37
CYP2C19 P33261 1/20 0.36
NPC1 O15118 1/20 0.35
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
POLB P06746 1/20 0.33
MKNK2 Q9HBH9 1/20 0.32
WDR5 P61964 1/20 0.32
PIM1 P11309 1/20 0.32
IRAK1 P51617 1/20 0.32
CAMK2B Q13554 1/20 0.32
CAMK2G Q13555 1/20 0.32
CAMK2D Q13557 1/20 0.32

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
SCHEMBL7005266 0.92 STAT3 (0.46) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7005450 0.85 STAT3 (0.48) STAT3HTTKDM4EHPGDKMT2A
SCHEMBL6576291 0.85 STAT3 (0.47) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7008762 0.84 STAT3 (0.41) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7004216 0.82 STAT3 (0.46) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7003690 0.79 STAT3 (0.51) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7004413 0.79 STAT3 (0.41) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7013130 0.79 STAT3 (0.44) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7007984 0.79 STAT3 (0.50) STAT3HTTKDM4EHPGDALDH1A1
SCHEMBL7010364 0.78 STAT3 (0.42) STAT3HTTKDM4EHPGDALDH1A1

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