SCHEMBL28685259

SCHEMBL28685259

Brc1ccc(C2(c3ccc(I)cc3)c3ccccc3-c3ccccc32)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
KDM4E B2RXH2 1/20 0.53
LMNA P02545 1/20 0.53
MAPT P10636 1/20 0.53
OPRK1 P41145 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
POLB P06746 1/20 0.38
PDK2 Q15119 2/20 0.37
NPSR1 Q6W5P4 3/20 0.33
APP P05067 1/20 0.33
MDM2 Q00987 1/20 0.33
S100A4 P26447 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
ALDH1A1 P00352 2/20 0.31
MAPK1 P28482 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL2231418 0.90 MEN1 (0.63) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL29365686 0.90 MEN1 (0.63) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL105865 0.90 MEN1 (0.63) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL28135141 0.90 MEN1 (0.63) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL30288909 0.90 MEN1 (0.63) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL283196 0.86 MEN1 (0.59) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL29506706 0.86 MEN1 (0.59) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL22618115 0.86 MEN1 (0.59) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL5494116 0.85 MEN1 (0.57) MEN1KMT2AKDM4ELMNAMAPT
SCHEMBL17816646 0.85 MEN1 (0.57) MEN1KMT2AKDM4ELMNAMAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113979903-B Organic thermal activation delayed fluorescence material containing phenylsulfone-spirofluorene structural unit, preparation method and application 杭州师范大学 2024-02-13 CN disclosed
CN-113979903-A Organic thermal activation delayed fluorescent material containing phenylsulfone-spirofluorene structural unit, preparation method and application 杭州师范大学 2022-01-28 CN disclosed