SCHEMBL7011899

SCHEMBL7011899

O=C(O)c1cn(-c2ccon2)c2c(Cl)c(-c3ccc4c(c3)CNC4)c(F)cc2c1=O

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 14/20 0.38
TOP2B Q02880 13/20 0.38
CYP3A4 P08684 2/20 0.37
CYP2C9 P11712 2/20 0.37
TOP1 P11387 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
POLB P06746 1/20 0.34
HSP90AA1 P07900 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34

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
SCHEMBL7006461 0.92 TOP2A (0.45) TOP2ATOP2BTOP1KDM4EALDH1A1
SCHEMBL7012384 0.90 TOP2A (0.42) TOP2ATOP2BTOP1KDM4EALDH1A1
SCHEMBL7010345 0.88 TOP2A (0.39) TOP2ATOP2BTOP1KDM4EALDH1A1
SCHEMBL7011692 0.84 LMNA (0.47) TOP2ATOP2BCYP3A4CYP2C9KDM4E
SCHEMBL7014477 0.83 TOP2A (0.48) TOP2ATOP2BCYP3A4CYP2C9KDM4E
SCHEMBL7011787 0.82 ALDH1A1 (0.40) TOP2ATOP2BCYP2C9TOP1KDM4E
SCHEMBL7010854 0.82 EPHA2 (0.43) TOP2ATOP2BCYP3A4CYP2C9TOP1
SCHEMBL7010843 0.81 EPHA2 (0.37) TOP2ATOP2BCYP3A4CYP2C9TOP1
SCHEMBL9048751 0.80 TOP1 (0.45) TOP2ATOP2BCYP3A4CYP2C9TOP1
SCHEMBL7007995 0.79 TOP2A (0.60) TOP2ATOP2BCYP2C9KDM4EALDH1A1

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-0775702-B1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2003-07-23 EP disclosed
US-5935952-A ANTIBACTERIAL AGENT TOYAMA CHEMICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0775702-A1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 1997-05-28 EP disclosed