SCHEMBL22745261

SCHEMBL22745261

CC(C)(O)C(=O)c1ccc(CC2(Cc3ccc(C(=O)C(C)(C)O)cc3)c3ccccc3-c3ccc(C(=O)c4ccccc4)cc32)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 13/20 0.51
▸ ABCC9 O60706 4/20 0.37
▸ ABCC8 Q09428 4/20 0.37
▸ KCNJ11 Q14654 4/20 0.37
▸ KCNJ8 Q15842 4/20 0.37
▸ PDK1 Q15118 2/20 0.36
▸ PDK3 Q15120 2/20 0.36
▸ PDK4 Q16654 2/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ CNR2 P34972 1/20 0.36

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
SCHEMBL22745165 0.95 PDK2 (0.47) PDK2ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL22745101 0.92 PDK2 (0.42) PDK2APEX1
SCHEMBL22745262 0.91 PDK2 (0.43) PDK2ABCC9ABCC8KCNJ11KCNJ8
SCHEMBL22745175 0.90 PDK2 (0.50) PDK2PDK1PDK3PDK4APEX1
SCHEMBL22745264 0.88 PDK2 (0.40) PDK2
SCHEMBL22745256 0.87 MAPK13 (0.38) PDK2
SCHEMBL22745114 0.86 PDK2 (0.58) PDK2APEX1CNR2
SCHEMBL22745428 0.86 PDK2 (0.49) PDK2APEX1
SCHEMBL22745252 0.85 PDK2 (0.56) PDK2CNR2
SCHEMBL22745171 0.85 PDK2 (0.35) PDK2

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-2020238862-A1 FLUORENE INITIATOR, PHOTOCURABLE COMPOSITION COMPRISING SAME, AND APPLICATION THEREOF 常州强力先端电子材料有限公司 2020-12-03 — — WO disclosed
Send feedback