SCHEMBL6865737

SCHEMBL6865737

CCOC(=O)c1cnc2c3c(nccc13)C(=O)c1ncccc1-2

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP2 O95551 4/20 0.51
IDO1 P14902 1/20 0.44
ALDH1A1 P00352 3/20 0.40
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GABRP O00591 1/20 0.40
GABRD O14764 1/20 0.40
GABRA1 P14867 1/20 0.40
GABRB1 P18505 1/20 0.40
GABRG2 P18507 1/20 0.40
GABRB3 P28472 1/20 0.40
GABRA5 P31644 1/20 0.40
GABRA3 P34903 1/20 0.40
GABRA2 P47869 1/20 0.40
GABRB2 P47870 1/20 0.40
GABRA4 P48169 1/20 0.40
GABRE P78334 1/20 0.40

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
SCHEMBL6866024 0.91 TDP2 (0.51) TDP2IDO1ALDH1A1LMNAMAPT
SCHEMBL7040428 0.83 MEN1 (0.42) TDP2GAA
SCHEMBL6407858 0.77 TDP2 (0.39) TDP2
SCHEMBL6411062 0.75 MEN1 (0.47) TDP2GAA
SCHEMBL6409081 0.74 HKDC1 (0.46) TDP2LMNAMAPTMAPK1ATM
Iodide SCHEMBL6859932 0.74 MEN1 (0.46) TDP2GAA
SCHEMBL6866894 0.74 KMT2A (0.41) TDP2LMNAMAPTMAPK1ATM
SCHEMBL7043300 0.73 TOP2A (0.52) TDP2GAA
SCHEMBL6411071 0.72 S100A4 (0.49) TDP2GAA
SCHEMBL6865755 0.72 MEN1 (0.47) TDP2GAA

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