SCHEMBL23654272

SCHEMBL23654272

N=C(/N=C(\N)c1ccccc1)c1c(-c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c2ccccc2c2ccccc12

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 6/20 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
SCHEMBL23655106 0.85 — —
SCHEMBL20405533 0.80 DHFR (0.30) —
SCHEMBL20407067 0.79 — —
SCHEMBL20405505 0.79 PDK2 (0.32) PDK2
SCHEMBL17233969 0.79 PDK2 (0.38) PDK2
SCHEMBL20405157 0.78 PRSS1 (0.38) —
SCHEMBL20405391 0.77 PDK2 (0.36) PDK2
SCHEMBL20404836 0.77 PDK2 (0.33) PDK2
SCHEMBL24742667 0.76 PDK2 (0.44) PDK2
SCHEMBL20407191 0.72 KDM4E (0.32) 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
EP-3351536-B1 ORGANIC LIGHT-EMITTING DEVICE LG CHEMICAL LTD (KR) 2021-07-21 — — EP disclosed
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