SCHEMBL25867010

SCHEMBL25867010

c1ccc(C2(c3ccccc3)c3cc(-c4cccc5c4C(c4ccccc4)(c4ccccc4)c4ccccc4O5)ccc3-c3cc4ccccc4cc32)cc1

nearest known ligand 0.33

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 13/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
OPRK1 P41145 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
CTSD P07339 1/20 0.30
BACE1 P56817 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
SCHEMBL25848168 0.96 PDK2 (0.33) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25866770 0.93 KDM4E (0.39) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25848523 0.92 KDM4E (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25857279 0.92 KDM4E (0.35) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849240 0.91 MEN1 (0.37) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25867013 0.91 PDK2 (0.32) PDK2CTSDBACE1
SCHEMBL25857037 0.91 KDM4E (0.39) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25848312 0.89 PDK2 (0.34) PDK2KDM4EMAPK1ATMCTSD
SCHEMBL25847401 0.89 KDM4E (0.34) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25849243 0.89 MEN1 (0.37) PDK2KDM4EMEN1LMNAMAPT

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