SCHEMBL29334608

SCHEMBL29334608

c1ccc(-c2cccc(Nc3ccc4c(c3)C3(c5ccccc5-4)c4ccccc4N(c4ccccc4)c4ccccc43)c2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.41
▸ GNG2 P59768 1/20 0.38
▸ GNB1 P62873 1/20 0.38
▸ PGR P06401 1/20 0.37
▸ BRD4 O60885 1/20 0.35
▸ ADAMTS5 Q9UNA0 1/20 0.33
▸ SYK P43405 3/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ HDAC3 O15379 1/20 0.32
▸ HDAC1 Q13547 1/20 0.32
▸ HDAC2 Q92769 1/20 0.32
▸ HDAC6 Q9UBN7 1/20 0.32
▸ GFER P55789 1/20 0.32
▸ PDE6D O43924 1/20 0.32
▸ SIRT2 Q8IXJ6 1/20 0.32
▸ SIRT1 Q96EB6 1/20 0.32
▸ MGLL Q99685 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ AR P10275 1/20 0.32

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
SCHEMBL22891467 0.91 PDK2 (0.49) PDK2GNG2GNB1PGRMEN1
SCHEMBL25569177 0.91 ALDH1A1 (0.38) PDK2GNG2GNB1PGRBRD4
SCHEMBL23637461 0.88 PGR (0.43) PDK2GNG2GNB1PGRADAMTS5
SCHEMBL17886978 0.87 PDK2 (0.51) PDK2BRD4SYKMEN1KMT2A
SCHEMBL29518615 0.87 PDK2 (0.51) PDK2BRD4SYKMEN1KMT2A
SCHEMBL22891464 0.86 PDK2 (0.46) PDK2GNG2GNB1PGRADAMTS5
SCHEMBL22661653 0.86 PDK2 (0.35) PDK2GNG2GNB1PGRADAMTS5
SCHEMBL22891763 0.85 GNG2 (0.40) PDK2GNG2GNB1PGRADAMTS5
SCHEMBL24969755 0.85 PGR (0.38) PDK2GNG2GNB1PGRAPP
SCHEMBL22891640 0.84 PDK2 (0.40) PDK2GNG2GNB1PGRBRD4

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
US-20240244964-A1 ORGANIC ELECTRONIC ELEMENT AND DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2024-07-18 — — US disclosed
US-20240244964-A1 ORGANIC ELECTRONIC ELEMENT AND DISPLAY DEVICE LG DISPLAY CO., LTD. (KR) 2024-07-18 — — US disclosed
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