SCHEMBL25257367

SCHEMBL25257367

Nc1ccc(NCCCCCCCNC(=O)O)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 7/20 0.46
F2 P00734 2/20 0.46
PRSS2 P07478 2/20 0.46
PRSS3 P35030 2/20 0.46
TMPRSS6 Q8IU80 2/20 0.46
ST14 Q9Y5Y6 2/20 0.46
HDAC3 O15379 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
NCOR2 Q9Y618 1/20 0.44
NQO2 P16083 1/20 0.42
ITGB3 P05106 1/20 0.42
ITGA2B P08514 1/20 0.42
MAPT P10636 3/20 0.41
RAB9A P51151 1/20 0.41
ALDH1A1 P00352 3/20 0.41
GLA P06280 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
HPGD P15428 1/20 0.39
ALOX12 P18054 1/20 0.39

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
SCHEMBL25205776 1.00 PRSS1 (0.46) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL7994942 0.87 MAPT (0.45) HDAC3HDAC1HDAC2MAPTRAB9A
SCHEMBL5305735 0.84 KMT2A (0.50) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL5807016 0.84 KMT2A (0.50) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL12712067 0.83 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL18549015 0.83 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL12736182 0.83 PRSS1 (0.55) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL4826255 0.83 HDAC3 (0.51) PRSS1F2PRSS2PRSS3TMPRSS6
SCHEMBL5791704 0.82 KMT2A (0.51) PRSS1MAPTRAB9AALDH1A1GLA
SCHEMBL5409961 0.82 ALDH1A1 (0.59) PRSS1F2PRSS2PRSS3TMPRSS6

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-2023091565-A1 NSD2-TARGETED CHEMICAL DEGRADERS AND COMPOSITIONS AND METHODS OF USE THEREOF THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2023-05-25 WO disclosed