SCHEMBL7009253

SCHEMBL7009253

COc1c(-c2ccc3c(c2)CN(C)C3)c(F)cc2c(=O)c(C(=O)O)cn(-c3ccc(O)cc3)c12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.47
TOP2B Q02880 5/20 0.47
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
CAPN1 P07384 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
HSP90AA1 P07900 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
PIM1 P11309 2/20 0.38
TOP1 P11387 6/20 0.37
GSK3B P49841 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
SCHEMBL7010005 0.94 LMNA (0.49) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7013034 0.91 TOP2A (0.45) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7006526 0.91 TOP2A (0.45) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7010887 0.90 TOP2A (0.56) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7009203 0.89 TOP2A (0.48) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7009251 0.88 TOP2A (0.47) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7008849 0.88 TOP2A (0.48) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7012392 0.86 KMT2A (0.44) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7014275 0.85 LMNA (0.49) TOP2ATOP2BMEN1LMNAKMT2A
SCHEMBL7008277 0.85 LMNA (0.47) TOP2ATOP2BMEN1LMNAKMT2A

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