SCHEMBL6410307

SCHEMBL6410307

COc1cnc2c(c1)C(=O)c1nccc3c(COC(C)=O)cnc-2c13

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.38
APP P05067 1/20 0.38
ACHE P22303 1/20 0.38
HPGD P15428 3/20 0.36
MAPT P10636 3/20 0.36
LMNA P02545 2/20 0.36
MAPK1 P28482 2/20 0.36
HTT P42858 2/20 0.36
KMT2A Q03164 2/20 0.36
ATM Q13315 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
TOP2A P11388 1/20 0.34
TDP1 Q9NUW8 8/20 0.34
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
PDE3B Q13370 1/20 0.34
PDE3A Q14432 1/20 0.34

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
SCHEMBL6407197 0.85 TOP2A (0.46) HKDC1TOP2ATDP2
SCHEMBL6408056 0.78 TOP2A (0.36) MAOAAPPACHEHPGDMAPT
SCHEMBL6407858 0.78 TDP2 (0.39) KMT2AHKDC1TOP2ATDP1TDP2
SCHEMBL6863937 0.73 TOP2A (0.50) MAOAHPGDMAPTLMNAMAPK1
SCHEMBL6866894 0.66 KMT2A (0.41) MAOAHPGDMAPTLMNAMAPK1
SCHEMBL6408548 0.64 TOP2A (0.53) MAOAHPGDMAPTLMNAMAPK1
SCHEMBL30511844 0.64 MTNR1A (0.64) HPGDLMNAMAPK1ALDH1A1F2
SCHEMBL1059319 0.63 ALDH1A1 (0.44) HPGDMAPK1HTTSMN1; SMN2ALDH1A1
SCHEMBL7043300 0.63 TOP2A (0.52) KMT2ATOP2ATDP1TDP2
SCHEMBL6866024 0.63 TDP2 (0.51) MAPTLMNAMAPK1KMT2AATM

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