SCHEMBL7008093

SCHEMBL7008093

CCOC(=O)c1cn(-c2cc(NC(=O)OCc3ccccc3)c(F)cc2F)c2c(F)c(F)c(Cl)cc2c1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 3/20 0.48
PIM1 P11309 1/20 0.40
IRAK1 P51617 1/20 0.40
CAMK2B Q13554 1/20 0.40
CAMK2G Q13555 1/20 0.40
CAMK2D Q13557 1/20 0.40
PIM3 Q86V86 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
P2RX3 P56373 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 3/20 0.37
LMNA P02545 1/20 0.37
MAPT P10636 1/20 0.37
KDM4E B2RXH2 3/20 0.36
HPGD P15428 2/20 0.36
CYP2C19 P33261 1/20 0.36

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
SCHEMBL7004207 0.92 STAT3 (0.43) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7007313 0.85 TSHR (0.47) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7012730 0.84 HTT (0.47) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7005450 0.83 STAT3 (0.48) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7005366 0.82 HTT (0.40) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7005460 0.81 PIM1 (0.41) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7009121 0.77 PIM1 (0.37) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7010692 0.77 PIM1 (0.40) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7005266 0.76 STAT3 (0.46) STAT3PIM1IRAK1CAMK2BCAMK2G
SCHEMBL7007549 0.74 ALDH1A1 (0.42) STAT3HTTKMT2ANPC1ALDH1A1

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-0787720-B1 PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT WAKUNAGA SEIYAKU KK (JP) 2003-07-16 EP disclosed
US-5910498-A NOVEL COMPOUNDS HAVING REDUCED CYTOTOXICITY, PHOTOTOXICITY; TREATING BACTERIAL AND VIRAL INFECTIONS WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1999-06-08 US disclosed
EP-0787720-A1 NOVEL PYRIDONECARBOXYLATE DERIVATIVE OR SALT THEREOF AND ANTIBACTERIAL CONTAINING THE SAME AS ACTIVE INGREDIENT WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1997-08-06 EP disclosed