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SCHEMBL25848428

SCHEMBL25848428

CC1(C)c2ccccc2Oc2ccc(-c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4cc5ccccc5cc43)cc21

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 9/20 0.33
▸ MEN1 O00255 1/20 0.31
▸ USP2 O75604 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ BACE1 P56817 3/20 0.30
▸ CTSD P07339 2/20 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
SCHEMBL25848160 0.96 PDK2 (0.36) PDK2
SCHEMBL25872806 0.95 PDK2 (0.38) PDK2BACE1
SCHEMBL25848516 0.94 CYP3A4 (0.32) PDK2MEN1USP2ALDH1A1LMNA
SCHEMBL25871492 0.93 PDK2 (0.37) PDK2BACE1
SCHEMBL25872289 0.93 PDK2 (0.34) PDK2BACE1CTSD
SCHEMBL25867951 0.93 PDK2 (0.35) PDK2
SCHEMBL25848717 0.92 PDK2 (0.33) PDK2MEN1USP2ALDH1A1LMNA
SCHEMBL25866242 0.89 PDK2 (0.36) PDK2
SCHEMBL25852646 0.89 PDK2 (0.33) PDK2MEN1USP2ALDH1A1LMNA
SCHEMBL25867534 0.89 PDK2 (0.36) PDK2BACE1

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-2023120714-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-06-29 — — WO disclosed