SCHEMBL25853196

SCHEMBL25853196

c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(-c4ccc5c(c4)C4(c6cc7ccccc7cc6O5)c5ccccc5-c5ccccc54)ccc32)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
MAPT P10636 3/20 0.38
KMT2A Q03164 3/20 0.38
LMNA P02545 2/20 0.38
KDM4E B2RXH2 1/20 0.38
OPRK1 P41145 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
PDK2 Q15119 10/20 0.35
HTT P42858 2/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.31
BACE1 P56817 2/20 0.31
ESR1 P03372 1/20 0.31
ESR2 Q92731 1/20 0.31
CTSD P07339 1/20 0.31
HPGD P15428 1/20 0.30
CYP2C19 P33261 1/20 0.30
RECQL P46063 1/20 0.30
BLM P54132 1/20 0.30
SMAD3 P84022 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
SCHEMBL25852118 0.94 PDK2 (0.38) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25858168 0.94 MEN1 (0.39) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25856913 0.93 MEN1 (0.39) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25848521 0.93 KDM4E (0.36) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25857535 0.91 PDK2 (0.36) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25851560 0.91 PDK2 (0.35) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25851899 0.91 PDK2 (0.32) MEN1MAPTKMT2ALMNAPDK2
SCHEMBL25866310 0.91 KDM4E (0.35) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25856605 0.90 PDK2 (0.33) MEN1MAPTKMT2ALMNAKDM4E
SCHEMBL25850079 0.90 MEN1 (0.41) MEN1MAPTKMT2ALMNAKDM4E

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