SCHEMBL15046376

SCHEMBL15046376

CC(=O)P(=O)(Cc1ccc2c(c1)C(C)(C)c1cc3c(cc1-2)C(C)(C)c1ccccc1N3)C(C)=O

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 7/20 0.34
▸ PDK4 Q16654 1/20 0.34
▸ IDO1 P14902 1/20 0.30
▸ TDO2 P48775 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
SCHEMBL15046236 0.78 PGR (0.37) PDK2PDK4
SCHEMBL12109291 0.76 PDK2 (0.50) PDK2PDK4
SCHEMBL12109367 0.76 PDK2 (0.50) PDK2PDK4
SCHEMBL15046273 0.76 PGR (0.32) PDK2
SCHEMBL12776583 0.75 PDK2 (0.46) PDK2PDK4
SCHEMBL15046115 0.72 FSHR (0.31) PDK2
SCHEMBL15046232 0.70 PDK2 (0.46) PDK2PDK4
SCHEMBL12723263 0.70 PDK2 (0.57) PDK2PDK4
SCHEMBL15046225 0.68 ITGB2 (0.35) —
SCHEMBL15046241 0.68 PDK2 (0.36) PDK2PDK4

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
WO-2013089460-A1 NOVEL CHEMICAL COMPOUND HAVING AN ACRIDINE STRUCTURE, AND ORGANIC LIGHT-EMITTING DIODE USING SAME 주식회사 두산 (KR) 2013-06-20 — — WO disclosed
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