SCHEMBL5140398

SCHEMBL5140398

CCCCOC(=O)C1(N)CCCCN1C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.37
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 4/20 0.35
MEN1 O00255 3/20 0.35
ALDH1A1 P00352 5/20 0.35
MAPT P10636 2/20 0.34
NPC1 O15118 1/20 0.34
TP53 P04637 1/20 0.34
NFKB1 P19838 1/20 0.34
RAB9A P51151 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
MAPK1 P28482 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
HPGD P15428 3/20 0.33
HCAR2 Q8TDS4 1/20 0.33
ATM Q13315 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
SCHEMBL18342156 0.96 SMN1; SMN2 (0.36) GAASMN1; SMN2LMNAPOLBKMT2A
SCHEMBL27500622 0.75 OPRD1 (0.45) GAASMN1; SMN2KMT2AMEN1ALDH1A1
SCHEMBL14463170 0.75 ALDH1A1 (0.47) SMN1; SMN2LMNAPOLBKMT2AMEN1
SCHEMBL5202981 0.74 ALDH1A1 (0.45) SMN1; SMN2LMNAKMT2AMEN1ALDH1A1
SCHEMBL8484892 0.74 JAK3 (0.33) HPGD
SCHEMBL30101056 0.71
SCHEMBL31386973 0.71 L3MBTL1 (0.38) KMT2AMEN1L3MBTL1
SCHEMBL16086201 0.70 ALDH1A1 (0.48) SMN1; SMN2LMNAPOLBKMT2AMEN1
SCHEMBL4719492 0.70 ALDH1A1 (0.48) SMN1; SMN2LMNAPOLBALDH1A1MAPT
SCHEMBL30665505 0.70 ALDH1A1 (0.31) SMN1; SMN2LMNAALDH1A1TP53TSHR

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-1904474-A1 NEW PYRIDINE ANALOGUES AstraZeneca AB (SE) 2008-04-02 EP disclosed
WO-2007008140-A1 NEW PYRIDINE ANALOGUES ASTRAZENECA AB (SE) 2007-01-18 WO disclosed