SCHEMBL25850078

SCHEMBL25850078

c1ccc(C2(c3ccccc3)c3ccccc3-c3cc(-c4ccc5c(c4)Oc4ccccc4C54c5ccccc5-c5ccccc54)ccc32)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
MAPT P10636 2/20 0.42
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
OPRK1 P41145 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
FTO Q9C0B1 2/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
BLM P54132 1/20 0.33
SMAD3 P84022 1/20 0.33
PRMT1 Q99873 1/20 0.33
ACE2 Q9BYF1 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
PDK2 Q15119 2/20 0.33

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
SCHEMBL25848721 1.00 MEN1 (0.42) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25850076 0.99 MEN1 (0.44) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25858303 0.94 MEN1 (0.42) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25849241 0.93 MEN1 (0.38) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25850079 0.93 MEN1 (0.41) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25858289 0.93 MEN1 (0.44) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25848724 0.93 MEN1 (0.37) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25848519 0.92 KDM4E (0.37) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25857621 0.92 MEN1 (0.37) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25850077 0.91 MEN1 (0.42) MEN1KMT2AMAPTKDM4ELMNA

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