SCHEMBL6407781

SCHEMBL6407781

COc1cnc2c(c1C)C(=O)c1cccnc1C2=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.50
HKDC1 Q2TB90 1/20 0.50
PADI1 Q9ULC6 1/20 0.50
PADI3 Q9ULW8 1/20 0.50
PADI4 Q9UM07 1/20 0.50
PADI2 Q9Y2J8 1/20 0.50
ATG4B Q9Y4P1 1/20 0.50
TDP2 O95551 7/20 0.45
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
NSD2 O96028 1/20 0.45
ABL1 P00519 1/20 0.45
PLCG1 P19174 1/20 0.45
CES1 P23141 1/20 0.45
PAX8 Q06710 1/20 0.45
RIN1 Q13671 1/20 0.45
THRB P10828 1/20 0.45
BLM P54132 1/20 0.45
GAA P10253 1/20 0.45

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
SCHEMBL6415723 0.94 S100A4 (0.50) S100A4HKDC1PADI1PADI3PADI4
SCHEMBL6410278 0.81 MAPT (0.36) HKDC1MEN1KMT2ATDP1KDM4E
SCHEMBL6414247 0.80 MAPT (0.37) HKDC1MEN1KMT2ATDP1KDM4E
SCHEMBL6413337 0.80 NSD2 (0.36) PADI1PADI3PADI4PADI2TDP2
SCHEMBL6410373 0.78 MAPT (0.36) HKDC1KMT2ATDP1KDM4EALDH1A1
SCHEMBL6415962 0.76 MAPT (0.37) HKDC1TDP2KMT2ATDP1KDM4E
SCHEMBL6407904 0.76 HTT (0.33) HKDC1KMT2ATDP1KDM4EMAPT
SCHEMBL6408518 0.74 TDP2 (0.55) S100A4HKDC1PADI1PADI3PADI4
SCHEMBL6410254 0.74 NSD2 (0.36) HKDC1PADI1PADI3PADI4PADI2
SCHEMBL6409081 0.74 HKDC1 (0.46) S100A4HKDC1PADI1PADI3PADI4

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202993-B1 PHENANTHROLINE-7-ONE DERIVATIVES AND THEIR THERAPEUTIC USES LAFON LABOR (FR) 2005-10-19 EP disclosed
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