SCHEMBL18987370

SCHEMBL18987370

CCCCOC(=O)N1CCCC1CCC(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MAPT P10636 1/20 0.37
EPHX2 P34913 2/20 0.37
GBA2 Q9HCG7 1/20 0.36
FKBP1A P62942 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ACE P12821 1/20 0.36
ACE2 Q9BYF1 1/20 0.36
PRCP P42785 1/20 0.35
RAB9A P51151 1/20 0.34
PRKCA P17252 2/20 0.34

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
SCHEMBL9761016 0.84 MAPT (0.43) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL14144107 0.82 POLB (0.45) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL5250880 0.81 POLB (0.44) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL3982504 0.81 POLB (0.53) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL1982237 0.81 POLB (0.53) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL6207733 0.81 POLB (0.53) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL5250883 0.81 POLB (0.44) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL27400845 0.81 ALDH1A1 (0.38) LMNAPOLBSMN1; SMN2L3MBTL1RAB9A
SCHEMBL6119301 0.80 MAPT (0.43) LMNAPOLBSMN1; SMN2MAPTGBA2
SCHEMBL7563929 0.80 POLB (0.43) LMNAPOLBSMN1; SMN2MAPTGBA2

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
EP-3390421-A1 METAL COMPLEXES University of Leeds (GB) 2018-10-24 EP disclosed
WO-2017103623-A1 METAL COMPLEXES UNIVERSITY OF LEEDS (GB) 2017-06-22 WO disclosed