SCHEMBL30838501

SCHEMBL30838501

COc1cc(-c2cnn(C(C)C(=O)NNc3cccnc3)c2)c2c(c1)C(O)(C(F)(F)F)c1ccccc1-2

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 19/20 0.58
▸ PDK4 Q16654 1/20 0.49

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
SCHEMBL30838494 1.00 PDK2 (0.58) PDK2PDK4
SCHEMBL30838487 0.90 PDK2 (0.58) PDK2PDK4
SCHEMBL30838479 0.90 PDK2 (0.59) PDK2PDK4
SCHEMBL30838483 0.89 PDK2 (0.57) PDK2PDK4
SCHEMBL30838528 0.89 PDK2 (0.58) PDK2PDK4
SCHEMBL30838536 0.89 PDK2 (0.60) PDK2PDK4
SCHEMBL30838535 0.89 PDK2 (0.60) PDK2PDK4
SCHEMBL30838480 0.87 PDK2 (0.58) PDK2PDK4
SCHEMBL30838518 0.87 PDK2 (0.56) PDK2PDK4
SCHEMBL30838511 0.86 PDK2 (0.59) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024071629-A1 NOVEL FLUORENE DERIVATIVE COMPOUND AND USE THEREOF (주)제이디바이오사이언스 2024-04-04 — — WO claimed
WO-2024071629-A1 NOVEL FLUORENE DERIVATIVE COMPOUND AND USE THEREOF (주)제이디바이오사이언스 2024-04-04 — — WO disclosed
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