SCHEMBL25849045

SCHEMBL25849045

CC1(c2ccccc2)c2ccccc2-c2cc(-c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3O4)ccc21

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
MAPT P10636 1/20 0.35
OPRK1 P41145 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
PDK2 Q15119 4/20 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
SCHEMBL25849051 0.95 PDK2 (0.32) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849315 0.94 PDK2 (0.35) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25871176 0.93 PDK2 (0.37) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25853203 0.93 KDM4E (0.38) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25849631 0.91 KDM4E (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25851904 0.91 PDK2 (0.34) MEN1LMNAMAPTKMT2APDK2
SCHEMBL25850077 0.91 MEN1 (0.42) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25872541 0.90 PDK2 (0.36) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25872073 0.90 PDK2 (0.33) KDM4EMEN1LMNAMAPTOPRK1
SCHEMBL25850079 0.90 MEN1 (0.41) KDM4EMEN1LMNAMAPTOPRK1

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