SCHEMBL25850077

SCHEMBL25850077

c1ccc(C2(c3ccccc3)c3ccccc3Oc3ccc(-c4ccc5c(c4)-c4ccccc4C5(c4ccccc4)c4ccccc4)cc32)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
PDK2 Q15119 11/20 0.35
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
POLB P06746 1/20 0.32
BACE1 P56817 2/20 0.31
CFTR P13569 1/20 0.31
GOPC Q9HD26 1/20 0.31
CTSD P07339 1/20 0.31
FTO Q9C0B1 2/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
HTT P42858 1/20 0.31
RECQL P46063 1/20 0.31

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
SCHEMBL25850079 0.99 MEN1 (0.41) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25850076 0.93 MEN1 (0.44) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25858291 0.93 MEN1 (0.44) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25849239 0.93 MEN1 (0.40) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25849631 0.92 KDM4E (0.36) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25848721 0.91 MEN1 (0.42) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25871175 0.91 PDK2 (0.41) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25847400 0.91 MEN1 (0.39) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25856611 0.91 MEN1 (0.41) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL25848725 0.91 PDK2 (0.36) 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