SCHEMBL7014195

SCHEMBL7014195

Cc1c(F)c(-c2ccc3c(c2)C(C)NC3C)c(C)c2c1c(=O)c(C(=O)O)cn2C1CC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 9/20 0.50
TOP2B Q02880 9/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KCNH2 Q12809 4/20 0.47
CACNA1F O60840 1/20 0.47
POLB P06746 1/20 0.47
MAPK1 P28482 1/20 0.47
CACNA1D Q01668 1/20 0.47
CACNA1S Q13698 1/20 0.47
CACNA1C Q13936 1/20 0.47
HRH3 Q9Y5N1 1/20 0.46
GSK3B P49841 5/20 0.44

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
SCHEMBL7005848 0.83 TOP2A (0.51) TOP2ATOP2BMEN1KMT2AKCNH2
SCHEMBL7013113 0.81 TOP2A (0.51) TOP2ATOP2BMEN1KMT2AKCNH2
SCHEMBL7013459 0.79 TOP2A (0.57) TOP2ATOP2BMEN1KMT2AKCNH2
SCHEMBL7011115 0.78 TOP2A (0.54) TOP2ATOP2BMEN1KMT2AKCNH2
SCHEMBL7013054 0.78 TOP2A (0.56) TOP2ATOP2BMEN1KMT2AKCNH2
SCHEMBL7011279 0.78 TOP2A (0.56) TOP2ATOP2BKCNH2POLBGSK3B
SCHEMBL7007612 0.78 KDM4E (0.56) TOP2ATOP2BMEN1KMT2AKCNH2
SCHEMBL8111016 0.78 TOP2A (0.58) TOP2ATOP2BMEN1KMT2AKCNH2
SCHEMBL7013977 0.75 TOP2A (0.53) TOP2ATOP2B
SCHEMBL5868648 0.74 GSK3B (0.60) TOP2ATOP2BMEN1KMT2AKCNH2

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