SCHEMBL24969179

SCHEMBL24969179

CC1(C)c2ccccc2-c2cc(Nc3ccc4c(c3)C(C)(C)c3cccc(-c5ccccc5)c3-4)ccc21

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 8/20 0.41
▸ APP P05067 1/20 0.33
▸ ABCB1 P08183 1/20 0.31
▸ ABCC1 P33527 1/20 0.31
▸ ABCG2 Q9UNQ0 1/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ AR P10275 1/20 0.31
▸ CAMK1D Q8IU85 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ LMNA P02545 1/20 0.30
▸ GAA P10253 1/20 0.30
▸ GFER P55789 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ NPSR1 Q6W5P4 1/20 0.30
▸ PGR P06401 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
SCHEMBL24968708 0.96 PDK2 (0.44) PDK2APPABCB1ABCC1ABCG2
SCHEMBL24969757 0.93 PDK2 (0.43) PDK2APPABCB1ABCC1ABCG2
SCHEMBL25657121 0.91 PDK2 (0.47) PDK2APPMEN1MAPTKMT2A
SCHEMBL30721691 0.91 PDK2 (0.47) PDK2APPMEN1MAPTKMT2A
SCHEMBL24406663 0.91 PDK2 (0.44) PDK2APPMEN1MAPTKMT2A
SCHEMBL24969648 0.90 PDK2 (0.43) PDK2APPMEN1MAPTKMT2A
SCHEMBL21582649 0.89 PDK2 (0.47) PDK2APPABCB1ABCC1ABCG2
SCHEMBL23561439 0.89 PDK2 (0.43) PDK2APPABCB1ABCC1ABCG2
SCHEMBL24969298 0.88 PDK2 (0.42) PDK2APPMEN1MAPTKMT2A
SCHEMBL24969710 0.87 ALDH1A1 (0.35) PDK2MAPTALDH1A1

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
WO-2023003234-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2023-01-26 — — WO disclosed
Send feedback