SCHEMBL25865146

SCHEMBL25865146

c1ccc2c(c1)-c1ccccc1C21c2cc(-c3ccc4c(c3)C3(c5ccccc5-c5ccccc53)c3c-4ccc4ccccc34)ccc2Oc2ccc3ccccc3c21

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 12/20 0.32
PTPRC P08575 1/20 0.32
KDM4E B2RXH2 2/20 0.31
NPC1 O15118 2/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
MAPT P10636 2/20 0.31
NFKB1 P19838 1/20 0.31
RAB9A P51151 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
ENPP3 O14638 1/20 0.31
ENPP1 P22413 1/20 0.31
CA12 O43570 3/20 0.30
CA1 P00915 3/20 0.30
CA2 P00918 3/20 0.30
CA9 Q16790 3/20 0.30
DHFR P00374 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
SCHEMBL25853628 1.00 PDK2 (0.32) PDK2PTPRCKDM4ENPC1ALDH1A1
SCHEMBL25850931 0.96 PDK2 (0.33) PDK2PTPRCKDM4ENPC1ALDH1A1
SCHEMBL25865152 0.94 PDK2 (0.32) PDK2
SCHEMBL25866175 0.94 KDM4E (0.32) PDK2KDM4ENPC1ALDH1A1LMNA
SCHEMBL25871092 0.93 PDK2 (0.33) PDK2KDM4ENPC1ALDH1A1LMNA
SCHEMBL25853717 0.93 PDK2 (0.33) PDK2
SCHEMBL25865248 0.93 PDK2 (0.34) PDK2KDM4ENPC1ALDH1A1LMNA
SCHEMBL25853630 0.92 PDK2 (0.33) PDK2
SCHEMBL25865148 0.92 PDK2 (0.33) PDK2
SCHEMBL25879342 0.91 KDM4E (0.32) PDK2KDM4ENPC1ALDH1A1LMNA

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