SCHEMBL338776

SCHEMBL338776

[CH2]CCN1CC(C(=O)O)CC1=O

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.58
SMN1; SMN2 Q16637 2/20 0.56
HTT P42858 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.52
ALDH1A1 P00352 1/20 0.50
HPGD P15428 1/20 0.48
MAPT P10636 1/20 0.47
GAA P10253 1/20 0.44
CASP1 P29466 1/20 0.41
CASP7 P55210 1/20 0.41
RECQL P46063 1/20 0.41

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
SCHEMBL7951946 0.89 POLB (0.66) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL1538426 0.89 POLB (0.66) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL31537583 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL15082395 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL10922468 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL31537602 0.84 POLB (0.60) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL15082385 0.82 POLB (0.58) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL316989 0.82 POLB (0.63) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL5499784 0.81 POLB (0.66) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1
SCHEMBL15082396 0.81 POLB (0.57) POLBSMN1; SMN2HTTL3MBTL1ALDH1A1

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-8097602-B1 Method of treating body insect infestation HOST PHARMACEUTICALS, LLC (US) 2012-01-17 US disclosed