SCHEMBL25856605

SCHEMBL25856605

c1ccc(C2(c3ccccc3-c3ccc4c(c3)C3(c5cc6ccccc6cc5O4)c4ccccc4-c4ccccc43)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 6/20 0.33
MEN1 O00255 2/20 0.33
LMNA P02545 2/20 0.33
MAPT P10636 2/20 0.33
KMT2A Q03164 2/20 0.33
KDM4E B2RXH2 1/20 0.33
OPRK1 P41145 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
CTSD P07339 3/20 0.32
BACE1 P56817 3/20 0.32
FTO Q9C0B1 1/20 0.31
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
HTT P42858 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
SCHEMBL25857712 0.96 KDM4E (0.34) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25857890 0.92 KDM4E (0.35) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25858168 0.91 MEN1 (0.39) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25852118 0.91 PDK2 (0.38) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25856759 0.90 MEN1 (0.38) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25857720 0.90 KDM4E (0.38) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25853196 0.90 MEN1 (0.38) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25852813 0.89 KDM4E (0.33) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25857535 0.89 PDK2 (0.36) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25856611 0.88 MEN1 (0.41) PDK2MEN1LMNAMAPTKMT2A

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