SCHEMBL30453765

SCHEMBL30453765

N#Cc1ccccc1-c1occc1-c1ccco1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 9/20 0.41
KMT2A Q03164 9/20 0.41
KDM4E B2RXH2 8/20 0.41
ALDH1A1 P00352 8/20 0.41
MAPT P10636 6/20 0.41
HPGD P15428 6/20 0.41
GAA P10253 5/20 0.41
POLB P06746 4/20 0.41
BLM P54132 3/20 0.41
ALOX15 P16050 2/20 0.41
HSD17B10 Q99714 2/20 0.41
USP2 O75604 1/20 0.41
ESR1 P03372 1/20 0.41
MAPK1 P28482 1/20 0.41
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
GLA P06280 3/20 0.41
RECQL P46063 2/20 0.41
PKM P14618 1/20 0.41
ALOX12 P18054 1/20 0.40

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
SCHEMBL30869964 0.87 MEN1 (0.42) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL31264118 0.86 MEN1 (0.50) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL8476284 0.86 MEN1 (0.50) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL8096121 0.84 PTPRC (0.46) PTPRCESR2TSHR
SCHEMBL30375147 0.75 ALDH1A1 (0.41) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL31612203 0.75 ADORA2A (0.49) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL31612199 0.75 ADORA2A (0.49) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL29683950 0.75 ADORA2A (0.49) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL29695129 0.74 ALDH1A1 (0.44) MEN1KMT2AKDM4EALDH1A1MAPT
SCHEMBL12679742 0.73 ADORA2A (0.54) MEN1KMT2AKDM4EALDH1A1MAPT

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
CN-115073401-B 2,3 '-bisfuran compound, 2,3' -oligomeric furan compound, and preparation methods and applications thereof 华南理工大学 2023-07-14 CN disclosed