SCHEMBL26697309

SCHEMBL26697309

O=C(c1ccccc1)C1(Br)C=CC=CC1Br

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
MAPK1 P28482 3/20 0.34
NPC1 O15118 2/20 0.34
KMT2A Q03164 2/20 0.34
RAB9A P51151 1/20 0.34
CES1 P23141 4/20 0.33
CES2 O00748 3/20 0.33
TSHR P16473 3/20 0.33
ALDH1A1 P00352 3/20 0.33
DAO P14920 1/20 0.33
NAPRT Q6XQN6 1/20 0.33
LMNA P02545 3/20 0.33
PTPN1 P18031 1/20 0.32
GSK3B P49841 1/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
HTT P42858 2/20 0.32
TDP1 Q9NUW8 3/20 0.32
HSD17B10 Q99714 2/20 0.32
CYP3A4 P08684 2/20 0.31
L3MBTL1 Q9Y468 2/20 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
SCHEMBL31709146 0.73 LMNA (0.39) MAPTMAPK1NPC1KMT2ARAB9A
SCHEMBL10628332 0.71 CES1 (0.34) MAPTMAPK1NPC1KMT2ARAB9A
SCHEMBL10711342 0.68 CES1 (0.34) MAPTMAPK1NPC1KMT2ACES1
SCHEMBL28359782 0.68 LMNA (0.37) MAPTMAPK1NPC1KMT2ACES1
SCHEMBL30448716 0.67 LMNA (0.36) MAPTMAPK1NPC1KMT2ACES1
SCHEMBL28919612 0.67 MAPT (0.35) MAPTMAPK1NPC1KMT2ACES1
SCHEMBL29238187 0.66 MMP9 (0.41) MAPTMAPK1NPC1KMT2ARAB9A
SCHEMBL29103858 0.66 LMNA (0.35) MAPTMAPK1NPC1CES1CES2
SCHEMBL19032029 0.65 CYP2C19 (0.37) MAPTMAPK1CES1CES2TSHR
SCHEMBL17179985 0.65 DAO (0.35) MAPK1KMT2ACES1CES2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018299-A1 HYPERBRANCHED POLYBENZENE, PREPARATION METHOD AND USE THEREOF SOOCHOW UNIVERSITY (CN) 2024-01-18 US disclosed
WO-2023226264-A1 HYPERBRANCHED POLYPHENYL AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 苏州大学 2023-11-30 WO disclosed
CN-114957692-B Hyperbranched polyphenyl and preparation method and application thereof 苏州大学 2023-08-11 CN disclosed
CN-114957692-A Hyperbranched polyphenyl, and preparation method and application thereof 苏州大学 2022-08-30 CN disclosed