SCHEMBL6408985

SCHEMBL6408985

Cc1ccnc2c1C(=O)c1nc(Cl)cc(Cl)c1C2=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 1/20 0.35
CYP1A2 P05177 1/20 0.35
SRC P12931 1/20 0.32
KMO O15229 1/20 0.31
ALDH1A1 P00352 1/20 0.30
ADORA2A P29274 1/20 0.30
ADORA2B P29275 1/20 0.30
NOS3 P29474 2/20 0.30
NOS2 P35228 2/20 0.30
DPP4 P27487 1/20 0.30
USP8 P40818 1/20 0.30

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
SCHEMBL6407332 0.95 CYP1A1 (0.34) CYP1A1CYP1A2SRCKMO
SCHEMBL6597630 0.84 CES1 (0.36) CYP1A1CYP1A2NOS3NOS2USP8
SCHEMBL6597622 0.80 NOS2 (0.43) ALDH1A1NOS3NOS2USP8
SCHEMBL7991158 0.76 NOS2 (0.43) ALDH1A1NOS3NOS2
SCHEMBL6407055 0.70 HPGD (0.40) CYP1A2KMOALDH1A1USP8
SCHEMBL13168838 0.69 NOS2 (0.42) NOS3NOS2USP8
SCHEMBL6410245 0.68 ALDH1A1 (0.35) ALDH1A1NOS3NOS2
SCHEMBL6407115 0.68 TDP2 (0.55)
SCHEMBL6407586 0.68 MAPT (0.40) ALDH1A1ADORA2AUSP8
Cleistopholine SCHEMBL6358965 0.67 ALDH1A1 (0.55) CYP1A1CYP1A2ALDH1A1ADORA2A

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 4 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 disclosed
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