SCHEMBL13434243

SCHEMBL13434243

O=CN1CCOCCOCCOCCOCCOCC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.39
CA12 O43570 2/20 0.38
CA7 P43166 1/20 0.38
CA14 Q9ULX7 1/20 0.38
LMNA P02545 1/20 0.37
MAPT P10636 3/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
ALDH1A1 P00352 2/20 0.36
HSD17B10 Q99714 1/20 0.36
TTR P02766 1/20 0.35
RECQL P46063 1/20 0.35
MGLL Q99685 1/20 0.35
KDM4E B2RXH2 1/20 0.34
CA1 P00915 1/20 0.33
CA9 Q16790 1/20 0.33
PKM P14618 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32

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
SCHEMBL16607618 1.00 SMN1; SMN2 (0.39) SMN1; SMN2CA12CA7CA14LMNA
SCHEMBL11841381 0.97
SCHEMBL7321 0.97
Hydrochloric Acid SCHEMBL5012159 0.94
Hydrochloric Acid SCHEMBL3855161 0.94 CA12 (0.38) SMN1; SMN2CA12CA7CA14LMNA
SCHEMBL27693198 0.92 CA12 (0.36) SMN1; SMN2CA12CA7CA14LMNA
SCHEMBL25224342 0.89 TSHR (0.43) SMN1; SMN2CA12CA7CA14MAPT
SCHEMBL4874102 0.89
Formic Acid SCHEMBL17969575 0.89 RECQL (0.37) SMN1; SMN2CA12CA7CA14LMNA
Dimethylamine SCHEMBL27638726 0.87 RECQL (0.40) SMN1; SMN2CA12CA7CA14LMNA

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-2010043218-A2 TETRATHIOL LIGANDS, METAL COMPLEXES, CONJUGATES, AND KITS, THE USE THEREOF IN NUCLEAR MEDICINE DIAGNOSTICS AND ENDORADIONUCLIDE THERAPY, AND METHOD FOR PRODUCING THE TETRATHIOL LIGANDS AND METAL COMPLEXES FORSCHUNGSZENTRUM DRESDEN - ROSSENDORF E. V. (DE) 2010-04-22 WO disclosed