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SCHEMBL23936683

SCHEMBL23936683

CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc(-c5cccc(-c6ccc7c(c6)C(C)(C)C(C)(C)c6cc(N(c8ccc(-c9ccccc9)cc8)c8ccc(-c9ccccc9)cc8)ccc6-7)c5)cc4)cc3)cc2C1(C)C

nearest known ligand 0.43

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 17/20 0.43
▸ PGR P06401 2/20 0.35
▸ RARA P10276 1/20 0.35
▸ RARB P10826 1/20 0.35
▸ RARG P13631 1/20 0.35

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
SCHEMBL23936630 0.97 PDK2 (0.40) PDK2PGR
SCHEMBL23936681 0.94 PDK2 (0.39) PDK2PGR
SCHEMBL23936601 0.94 PDK2 (0.40) PDK2PGR
SCHEMBL23936631 0.94 PDK2 (0.40) PDK2PGR
SCHEMBL23936604 0.94 PDK2 (0.41) PDK2
SCHEMBL23936682 0.93 PDK2 (0.40) PDK2PGR
SCHEMBL23936680 0.93 PDK2 (0.42) PDK2
SCHEMBL23936815 0.93 PDK2 (0.42) PDK2
SCHEMBL23936685 0.93 PDK2 (0.42) PDK2PGR
SCHEMBL23936261 0.92 PDK2 (0.39) PDK2PGRRARARARBRARG

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-20210328150-A1 ORGANIC ELECTROLUMINESCENT COMPOUND, ORGANIC ELECTROLUMINESCENT MATERIAL COMPRISING THE SAME, AND ORGANIC ELECTROLUMINESCENT DEVICE DUPONT SPECIALTY MATERIALS KOREA LTD. (KR) 2021-10-21 — — US disclosed