SCHEMBL6409833

SCHEMBL6409833

O=C1c2c(Cl)ccnc2-c2nccc3ccnc1c23

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 3/20 0.40
DAO P14920 1/20 0.36
KMT2A Q03164 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
CASP1 P29466 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
CREBBP Q92793 1/20 0.35
S100A4 P26447 1/20 0.33
CDC25B P30305 1/20 0.33
AURKA O14965 1/20 0.32

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
SCHEMBL6407853 0.86 MAOA (0.40) MAOADAOKMT2ATDP1KDM4E
SCHEMBL22580777 0.82 S100A4 (0.41) MAOADAOKMT2ATDP1S100A4
SCHEMBL6859938 0.79 MAOA (0.40) MAOAKMT2ATDP1KDM4ELMNA
SCHEMBL6865846 0.75 MAOA (0.37) MAOAKMT2ATDP1KDM4ELMNA
SCHEMBL6407178 0.75 MAPT (0.50) MAOAKMT2ATDP1KDM4ELMNA
SCHEMBL6597630 0.73 CES1 (0.36) DAOKMT2ATDP1S100A4CDC25B
SCHEMBL22606118 0.73 HSP90AA1 (0.36) MAOADAOKMT2ATDP1KDM4E
SCHEMBL17077597 0.70 TDP2 (0.66) KMT2ATDP1S100A4CDC25BTOP2A
SCHEMBL6414025 0.69 TDP2 (0.64) MAOAKMT2ATDP1S100A4CDC25B
SCHEMBL14341533 0.69 MAOA (0.60) MAOAS100A4CDC25B

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 5 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 claimed
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 claimed
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