SCHEMBL26050347

SCHEMBL26050347

O=c1oc2cc(N3CCC3)ccc2cc1-c1nc2ccccc2o1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.64
NPC1 O15118 7/20 0.64
RAB9A P51151 7/20 0.64
MAPT P10636 6/20 0.64
SMN1; SMN2 Q16637 6/20 0.64
ALDH1A1 P00352 5/20 0.64
HPGD P15428 5/20 0.64
HSD17B10 Q99714 3/20 0.64
TP53 P04637 2/20 0.64
PKM P14618 2/20 0.64
GLA P06280 1/20 0.64
GAA P10253 1/20 0.64
CASP1 P29466 1/20 0.64
CASP7 P55210 1/20 0.64
KMT2A Q03164 3/20 0.54
MEN1 O00255 2/20 0.54
TSHR P16473 1/20 0.54
MAPK1 P28482 2/20 0.51
SLC16A3 O15427 1/20 0.45
ALK Q9UM73 1/20 0.43

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
SCHEMBL26050345 0.98 KDM4E (0.64) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL26050343 0.97 KDM4E (0.63) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL15069086 0.93 KDM4E (0.56) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL4510937 0.90 KDM4E (0.60) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL25997252 0.85 KDM4E (0.60) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL22372349 0.84 KDM4E (0.58) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL22388888 0.83 SLC16A3 (0.50) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL21301263 0.83 KDM4E (0.57) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL15068889 0.83 KDM4E (0.57) KDM4ENPC1RAB9AMAPTSMN1; SMN2
SCHEMBL15069051 0.82 KDM4E (0.53) KDM4ENPC1RAB9AMAPTSMN1; SMN2

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
US-12031178-B2 Cyclooctatetraene containing dyes and compositions ILLUMINA CAMBRIDGE LIMITED (GB) 2024-07-09 US disclosed
US-20230265502-A1 CYCLOOCTATETRAENE CONTAINING DYES AND COMPOSITIONS ILLUMINA CAMBRIDGE LIMITED (GB) 2023-08-24 US disclosed