SCHEMBL6408366

SCHEMBL6408366

COc1ccc2c(n1)-c1nccc3ccnc(c13)C2=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.45
HPGD P15428 3/20 0.45
LMNA P02545 2/20 0.45
MAPK1 P28482 2/20 0.45
HTT P42858 2/20 0.45
KMT2A Q03164 2/20 0.45
KDM4E B2RXH2 2/20 0.45
POLB P06746 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CASP1 P29466 1/20 0.45
CYP2C19 P33261 1/20 0.45
CREBBP Q92793 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAOA P21397 4/20 0.41
ACHE P22303 2/20 0.40
APP P05067 1/20 0.40
IDO1 P14902 1/20 0.40
HKDC1 Q2TB90 2/20 0.39

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
SCHEMBL6412920 0.88 MAOA (0.44) MAPTHPGDLMNAMAPK1HTT
SCHEMBL6407769 0.83 LMNA (0.44) MAPTHPGDLMNAMAPK1HTT
SCHEMBL6413377 0.77 NSD2 (0.40) MAPTHPGDLMNAMAPK1HTT
SCHEMBL6407305 0.75 HPGD (0.48) MAPTHPGDLMNAMAPK1HTT
SCHEMBL6414025 0.74 TDP2 (0.64) KMT2ATDP1MAOAHKDC1S100A4
SCHEMBL6408454 0.74 NSD2 (0.40) MAPTHPGDLMNAMAPK1HTT
SCHEMBL6412752 0.72 HPGD (0.48) MAPTHPGDLMNAMAPK1HTT
SCHEMBL6407178 0.72 MAPT (0.50) MAPTHPGDLMNAMAPK1HTT
SCHEMBL6408521 0.72 LMNA (0.42) MAPTHPGDLMNAMAPK1HTT
SCHEMBL7180413 0.70 TOP2A (0.54) MAPTHPGDLMNAMAPK1HTT

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-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