SCHEMBL6863937

SCHEMBL6863937

COCc1cnc2c3c(nccc13)C(=O)c1cccnc1-2

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 1/20 0.50
TDP2 O95551 3/20 0.44
NSD2 O96028 2/20 0.44
PAX8 Q06710 2/20 0.44
ABL1 P00519 1/20 0.44
PLCG1 P19174 1/20 0.44
CES1 P23141 1/20 0.44
RIN1 Q13671 1/20 0.44
GAA P10253 1/20 0.44
S100A4 P26447 3/20 0.40
HKDC1 Q2TB90 2/20 0.40
PADI1 Q9ULC6 1/20 0.40
PADI3 Q9ULW8 1/20 0.40
PADI4 Q9UM07 1/20 0.40
PADI2 Q9Y2J8 1/20 0.40
ATG4B Q9Y4P1 1/20 0.40
PTPRC P08575 2/20 0.38
CTSL P07711 1/20 0.38
CTSS P25774 1/20 0.38
PTPN13 Q12923 1/20 0.38

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
SCHEMBL6866894 0.90 KMT2A (0.41) TOP2ATDP2NSD2PAX8ABL1
SCHEMBL6407197 0.86 TOP2A (0.46) TOP2ATDP2NSD2PAX8ABL1
SCHEMBL6408548 0.81 TOP2A (0.53) TOP2ATDP2NSD2PAX8ABL1
SCHEMBL6407858 0.76 TDP2 (0.39) TOP2ATDP2S100A4HKDC1PADI1
SCHEMBL6409824 0.76 TOP2A (0.57) TOP2ATDP2NSD2PAX8ABL1
SCHEMBL6412880 0.76 TOP2A (0.57) TOP2ATDP2NSD2PAX8ABL1
SCHEMBL6867428 0.76 TOP2A (0.57) TOP2ATDP2NSD2PAX8ABL1
SCHEMBL6407790 0.75 TOP2A (0.53) TOP2ATDP2NSD2PAX8ABL1
Iodide SCHEMBL6867075 0.75 TOP2A (0.56) TOP2ATDP2NSD2PAX8ABL1
SCHEMBL7043300 0.74 TOP2A (0.52) TOP2ATDP2NSD2PAX8ABL1

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
US-6809096-B1 SUCH AS 11-METHOXY-7H-PYRIDO(4,3,2-DE)(1,7)PHENANTHROLINE-7-ONE; ANTITUMOR AGENTS LABORATOIRE L. LAFON (FR) 2004-10-26 US disclosed
EP-1202993-A2 PHENANTHROLINE-7-ONE DERIVATIVES AND THEIR THERAPEUTIC USES LABORATOIRE L. LAFON (FR) 2002-05-08 EP disclosed
WO-2001012632-A2 PHENANTHROLINE-7-ONE DERIVATIVES AND THEIR THERAPEUTIC USES LABORATOIRE L. LAFON (FR) 2001-02-22 WO disclosed