SCHEMBL14747678

SCHEMBL14747678

CCCCCCN(CCCCCC)c1ccc(C=Cc2sc3cc(S(=O)(=O)N4CCCCC4)ccc3[n+]2CCCC[SH](=O)=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ INSR P06213 13/20 0.54
▸ MEN1 O00255 3/20 0.35
▸ HTT P42858 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ TP53 P04637 2/20 0.35
▸ TSHR P16473 2/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ NPSR1 Q6W5P4 1/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.34
▸ LMNA P02545 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.33
▸ MAPT P10636 1/20 0.33
▸ VDR P11473 1/20 0.33
▸ HPGD P15428 1/20 0.33
▸ GFER P55789 1/20 0.33
▸ GPR55 Q9Y2T6 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ PKM P14618 1/20 0.33

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
SCHEMBL1105774 0.91 INSR (0.53) INSRMEN1HTTKMT2ATP53
SCHEMBL14708621 0.89 INSR (0.51) INSRMEN1HTTKMT2ATP53
SCHEMBL14747441 0.71 ALDH1A1 (0.40) MEN1HTTKMT2ATP53TSHR
SCHEMBL1105772 0.71 INSR (0.52) INSR
Iodide SCHEMBL8390160 0.71 INSR (0.98) INSR
Iodide SCHEMBL8390162 0.71 INSR (0.98) INSR
SCHEMBL14706829 0.70 LMNA (0.43) INSRMEN1HTTKMT2ATP53
SCHEMBL14747446 0.69 INSR (0.49) INSRHTTNPSR1L3MBTL1MAPT
SCHEMBL14706830 0.67 INSR (0.40) INSRMEN1HTTKMT2ATSHR
Iodide SCHEMBL8390009 0.66 INSR (0.98) INSR

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
US-8389729-B2 Methods for detecting the presence, location or quantity of targets using novel dyes ENZO LIFE SCIENCES, INC. (US) 2013-03-05 — — US disclosed
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