SCHEMBL25849051

SCHEMBL25849051

CC1(c2ccccc2)c2ccccc2-c2cc(-c3ccc4c(c3)C3(c5ccccc5O4)c4ccccc4-c4ccccc43)ccc21

nearest known ligand 0.32

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
MAPT P10636 1/20 0.32
OPRK1 P41145 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
BACE1 P56817 2/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
PGR P06401 1/20 0.31
CTSD P07339 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
SCHEMBL25849045 0.95 KDM4E (0.35) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25851741 0.94 PDK2 (0.33) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25849049 0.94 MEN1 (0.33) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25849317 0.94 PDK2 (0.35) PDK2BACE1ESR1ESR2PGR
SCHEMBL25851904 0.91 PDK2 (0.34) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25851899 0.91 PDK2 (0.32) PDK2MEN1LMNAMAPTKMT2A
SCHEMBL25873432 0.90 PDK2 (0.36) PDK2BACE1PGRCTSD
SCHEMBL25853203 0.90 KDM4E (0.38) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25851740 0.90 MEN1 (0.33) PDK2KDM4EMEN1LMNAMAPT
SCHEMBL25850079 0.90 MEN1 (0.41) 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