SCHEMBL9211190

SCHEMBL9211190

CCOC(=O)c1cn(C2CC2)c2c(F)c(N3CCOC3)c(F)c(F)c2c1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 2/20 0.52
KMT2A Q03164 2/20 0.51
MEN1 O00255 1/20 0.51
TSHR P16473 1/20 0.46
CASP1 P29466 1/20 0.46
ADRB2 P07550 1/20 0.44
KCNH2 Q12809 2/20 0.44
CACNA1F O60840 1/20 0.44
POLB P06746 1/20 0.44
MAPK1 P28482 1/20 0.44
CACNA1D Q01668 1/20 0.44
CACNA1S Q13698 1/20 0.44
CACNA1C Q13936 1/20 0.44
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
TOP2A P11388 2/20 0.43
TOP2B Q02880 2/20 0.43
HTT P42858 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
SCHEMBL9208725 0.86 MEN1 (0.67) STAT3KMT2AMEN1KCNH2CACNA1F
SCHEMBL9208720 0.85 ADRB2 (0.57) STAT3KMT2AADRB2KCNH2POLB
SCHEMBL10777266 0.85 MEN1 (0.55) STAT3KMT2AMEN1TSHRCASP1
SCHEMBL1345146 0.84 STAT3 (0.65) STAT3KMT2AMEN1TSHRCASP1
SCHEMBL9208068 0.80 ADRB2 (0.55) STAT3KMT2AADRB2KCNH2POLB
SCHEMBL9720451 0.80 STAT3 (0.54) STAT3KMT2AMEN1TSHRCASP1
SCHEMBL10679793 0.80 MEN1 (0.70) STAT3KMT2AMEN1KCNH2CACNA1F
SCHEMBL9585893 0.80 STAT3 (0.54) STAT3KMT2AMEN1TSHRCASP1
SCHEMBL10339785 0.79 STAT3 (0.53) STAT3KMT2AMEN1TSHRCASP1
SCHEMBL9267912 0.79 STAT3 (0.61) STAT3KMT2AMEN1TSHRCASP1

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-0390215-B1 Quinolone derivatives and salts thereof, preparation process es thereof, and antibacterial agents containing the same WAKUNAGA SEIYAKU KK (JP) 1995-06-07 EP disclosed
US-5153203-A QUINOLONE DERIVATIVES AND SALTS THEREOF, PREPARATION PROCESSES THEREOF, AND ANTIBACTERIAL AGENTS CONTAINING THE SAME WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1992-10-06 US disclosed
EP-0390215-A2 Quinolone derivatives and salts thereof, preparation process es thereof, and antibacterial agents containing the same WAKUNAGA SEIYAKU KABUSHIKI KAISHA (JP) 1990-10-03 EP disclosed