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SCHEMBL25850935

SCHEMBL25850935

Cc1ccc2c(c1C)C1(c3ccccc3-c3ccc(-c4ccc5c(c4)C4(c6cc7ccccc7cc6O5)c5ccccc5-c5ccccc54)cc31)c1ccccc1-2

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 15/20 0.36
▸ CTSD P07339 1/20 0.32
▸ BACE1 P56817 1/20 0.32
▸ 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
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 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
SCHEMBL25866435 0.84 PDK2 (0.38) PDK2
SCHEMBL25853630 0.84 PDK2 (0.33) PDK2
SCHEMBL25866433 0.84 PDK2 (0.33) PDK2
SCHEMBL25851326 0.82 PDK2 (0.32) PDK2CTSDBACE1MEN1USP2
SCHEMBL25852118 0.81 PDK2 (0.38) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25852352 0.81 PDK2 (0.36) PDK2
SCHEMBL25866439 0.81 PDK2 (0.36) PDK2CTSDBACE1
SCHEMBL25851560 0.81 PDK2 (0.35) PDK2MEN1USP2ALDH1A1LMNA
SCHEMBL25866480 0.80 PDK2 (0.36) PDK2
SCHEMBL25848310 0.80 PDK2 (0.38) PDK2

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