SCHEMBL19412437

SCHEMBL19412437

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccc(S(C)(C)C)cc5)cc4)cc3)c3ccc(S(c4ccccc4)(c4ccccc4)c4ccccc4)cc3)cc21

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 3/20 0.33
▸ PTGS2 P35354 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
SCHEMBL18518003 0.94 PDK2 (0.35) PDK2PTGS2
SCHEMBL24905288 0.94 PDK2 (0.35) PDK2PTGS2
SCHEMBL20051855 0.89 PDK2 (0.33) PDK2
SCHEMBL25502945 0.87 PDK2 (0.32) PDK2
SCHEMBL25686700 0.86 PDK2 (0.37) PDK2
SCHEMBL22183166 0.85 PDK2 (0.33) PDK2
SCHEMBL20051858 0.85 PDK2 (0.35) PDK2
SCHEMBL16922895 0.85 PDK2 (0.41) PDK2
SCHEMBL24904901 0.85 PDK2 (0.41) PDK2
SCHEMBL20707545 0.85 PDK2 (0.43) 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
US-9780317-B2 Amine derivative, organic luminescent material and organic electroluminescent device using the amine derivative or the organic luminescent material SAMSUNG DISPLAY CO., LTD. (KR) 2017-10-03 — — US disclosed
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