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SCHEMBL12429149

SCHEMBL12429149

CC1(C)c2ccccc2-c2ccc(-c3cc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)c4ccc5c(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)cc(-c6ccc7c(c6)C(C)(C)c6ccccc6-7)nc5c4n3)cc21

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 16/20 0.37
▸ ACACA Q13085 2/20 0.33
▸ DHFR P00374 1/20 0.33

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
SCHEMBL2950434 0.94 ACACA (0.40) PDK2ACACA
SCHEMBL26563516 0.86 PDK2 (0.36) PDK2ACACA
SCHEMBL24654489 0.85 PDK2 (0.34) PDK2ACACA
SCHEMBL9976749 0.85 PDK2 (0.35) PDK2ACACA
SCHEMBL9976741 0.85 PDK2 (0.35) PDK2ACACA
SCHEMBL9976740 0.83 PDK2 (0.36) PDK2
SCHEMBL19655412 0.83 PDK2 (0.36) PDK2ACACA
SCHEMBL17875542 0.82 PDK2 (0.41) PDK2ACACA
SCHEMBL17875496 0.82 NPC1 (0.36) PDK2ACACA
SCHEMBL17875526 0.82 PDK2 (0.41) PDK2ACACA

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7982213-B2 Phenanthroline compound and organic light emitting device using same CANON KABUSHIKI KAISHA (JP) 2011-07-19 — — US disclosed
US-7982213-B2 Phenanthroline compound and organic light emitting device using same CANON KABUSHIKI KAISHA (JP) 2011-07-19 — — US disclosed
US-20090218940-A1 PHENANTHROLINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME CANON KABUSHIKI KAISHA (JP) 2009-09-03 — — US disclosed
US-20090218940-A1 PHENANTHROLINE COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME CANON KABUSHIKI KAISHA (JP) 2009-09-03 — — US disclosed
US-7550594-B2 Phenanthroline compound and organic light emitting device using same CANON KABUSHIKI KAISHA (JP) 2009-06-23 — — US disclosed
US-7550594-B2 Phenanthroline compound and organic light emitting device using same CANON KABUSHIKI KAISHA (JP) 2009-06-23 — — US disclosed