SCHEMBL24968708

SCHEMBL24968708

CC1(C)c2ccccc2-c2ccc(Nc3ccc4c(c3)C(C)(C)c3cccc(-c5ccccc5)c3-4)cc21

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 11/20 0.44
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ AR P10275 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ APP P05067 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ PGR P06401 2/20 0.32
▸ ABCB1 P08183 1/20 0.30
▸ ABCC1 P33527 1/20 0.30
▸ ABCG2 Q9UNQ0 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
SCHEMBL24969757 0.97 PDK2 (0.43) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL24969179 0.96 PDK2 (0.41) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL25657121 0.94 PDK2 (0.47) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL30721691 0.94 PDK2 (0.47) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL24406663 0.94 PDK2 (0.44) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL24969648 0.93 PDK2 (0.43) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL24969298 0.92 PDK2 (0.42) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL25647182 0.90 PDK2 (0.46) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL21582649 0.90 PDK2 (0.47) PDK2MEN1ALDH1A1ARMAPT
SCHEMBL30785104 0.90 ALDH1A1 (0.45) PDK2MEN1ALDH1A1MAPTKMT2A

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
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