SCHEMBL24293168

SCHEMBL24293168

CC1(C)c2ccccc2C2(c3ccccc3-c3ccccc32)c2cc(-c3cccc(-c4cccs4)c3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 6/20 0.51
▸ KCNH2 Q12809 1/20 0.40
▸ ADORA1 P30542 1/20 0.39
▸ PGR P06401 1/20 0.39
▸ LPL P06858 1/20 0.38
▸ LIPG Q9Y5X9 1/20 0.38
▸ PRMT6 Q96LA8 1/20 0.38
▸ ALOX5 P09917 1/20 0.38
▸ PTGS1 P23219 1/20 0.38
▸ PTGS2 P35354 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ SLC6A11 P48066 1/20 0.36
▸ LTA4H P09960 1/20 0.35
▸ HDAC1 Q13547 3/20 0.34
▸ HDAC2 Q92769 3/20 0.34
▸ HDAC3 O15379 2/20 0.34

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
SCHEMBL21868055 0.92 PDK2 (0.56) PDK2KCNH2PGRLPLLIPG
SCHEMBL21868318 0.89 PDK2 (0.52) PDK2KCNH2PGRLPLLIPG
SCHEMBL24647700 0.89 PDK2 (0.55) PDK2KCNH2ADORA1PGRLPL
SCHEMBL12306540 0.88 PDK2 (0.58) PDK2KCNH2ADORA1PGRLPL
SCHEMBL21868421 0.86 PDK2 (0.40) PDK2KCNH2ADORA1PGRLPL
SCHEMBL12306511 0.85 PDK2 (0.52) PDK2KCNH2ADORA1PGRLPL
SCHEMBL21868560 0.85 PDK2 (0.42) PDK2KCNH2ADORA1PGRLPL
SCHEMBL12306535 0.84 PDK2 (0.52) PDK2KCNH2ADORA1PGRLPL
SCHEMBL21868266 0.83 PDK2 (0.65) PDK2KCNH2ADORA1PGRALOX5
SCHEMBL24647812 0.82 PDK2 (0.58) PDK2KCNH2PGRLPLLIPG

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230024114-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2023-01-26 — — US disclosed
US-20220376178-A1 ORGANIC LIGHT-EMITTING DEVICE LG CHEM, LTD. (KR) 2022-11-24 — — US disclosed
US-20220123218-A1 ORGANIC ELECTROLUMINESCENT DEVICE LG CHEM, LTD. (KR) 2022-04-21 — — US disclosed
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