SCHEMBL8324436

SCHEMBL8324436

CCCCOC(=O)N1CCCC(C)C1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.61
MEN1 O00255 3/20 0.61
MAPT P10636 3/20 0.61
KMT2A Q03164 3/20 0.61
SMN1; SMN2 Q16637 4/20 0.55
LMNA P02545 3/20 0.55
ALDH1A1 P00352 5/20 0.50
HPGD P15428 3/20 0.45
GAA P10253 1/20 0.45
KDM4E B2RXH2 1/20 0.43
NPC1 O15118 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43
ATM Q13315 1/20 0.42
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
SCHEMBL16472455 0.85 ALDH1A1 (0.57) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL12683458 0.85 ALDH1A1 (0.57) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL10517488 0.85 ALDH1A1 (0.57) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL3649936 0.85 POLB (0.51) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL3649934 0.85 POLB (0.51) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL30497646 0.85 POLB (0.51) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL20912047 0.84 POLB (0.56) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL1404236 0.84 POLB (0.50) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL31554318 0.84 POLB (0.50) POLBMEN1MAPTKMT2ASMN1; SMN2
SCHEMBL8324568 0.84 POLB (0.50) POLBMEN1MAPTKMT2ASMN1; SMN2

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-2004048383-A1 MIXED LINEAGE KINASE MODULATORS ELI LILLY AND COMPANY (US) 2004-06-10 WO disclosed