SCHEMBL6859938

SCHEMBL6859938

O=C1c2c(O)ccnc2-c2nccc3ccnc1c23

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 5/20 0.40
KMT2A Q03164 3/20 0.35
MAPT P10636 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
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
TOP2A P11388 1/20 0.31
TERT O14746 1/20 0.31
MEN1 O00255 2/20 0.31
TDP2 O95551 1/20 0.31

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
SCHEMBL6865318 0.86 MAOA (0.40) MAOAKMT2AMAPTTDP1KDM4E
SCHEMBL6409833 0.79 MAOA (0.40) MAOAKMT2AMAPTTDP1KDM4E
SCHEMBL29145973 0.77 MAPT (0.40) MAOAKMT2AMAPTTDP1KDM4E
SCHEMBL6407178 0.75 MAPT (0.50) MAOAKMT2AMAPTTDP1KDM4E
SCHEMBL6865846 0.75 MAOA (0.37) MAOAKMT2AMAPTTDP1KDM4E
SCHEMBL16072070 0.75 TOP2A (0.64) MAOAKMT2AMAPTKDM4ELMNA
SCHEMBL7215902 0.75 TERT (0.57) MAOAKMT2AMAPTKDM4ELMNA
SCHEMBL22606118 0.73 HSP90AA1 (0.36) MAOAKMT2AMAPTTDP1KDM4E
SCHEMBL6414025 0.69 TDP2 (0.64) MAOAKMT2ATDP1TOP2AMEN1
SCHEMBL6866900 0.69 MAOA (0.45) MAOAKMT2AMAPTTDP1KDM4E

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 1 patent. 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