SCHEMBL3922358

SCHEMBL3922358

C#CC1CCCN1C(=O)OCCCC

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
POLB P06746 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
DPP4 P27487 7/20 0.41
GBA2 Q9HCG7 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RAB9A P51151 1/20 0.37
FAP Q12884 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
DPP7 Q9UHL4 1/20 0.36
ALDH1A1 P00352 1/20 0.36

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
SCHEMBL7172715 0.87 LMNA (0.43) LMNAPOLBSMN1; SMN2DPP4GBA2
SCHEMBL21243398 0.86 DPP4 (0.56) DPP4DPP8DPP9
SCHEMBL9769179 0.82 GBA2 (0.47) LMNAPOLBSMN1; SMN2DPP4GBA2
SCHEMBL30529416 0.82 DPP4 (0.52) DPP4DPP8DPP9DPP7
SCHEMBL25508554 0.82 RAB9A (0.36) DPP4RAB9A
SCHEMBL25505066 0.82 RAB9A (0.36) RAB9A
SCHEMBL4202768 0.79 POLB (0.46) LMNAPOLBSMN1; SMN2DPP4GBA2
SCHEMBL2731646 0.79 POLB (0.46) LMNAPOLBSMN1; SMN2DPP4GBA2
SCHEMBL31753062 0.79 LMNA (0.39) LMNAPOLBSMN1; SMN2GBA2ALDH1A1
SCHEMBL14144107 0.78 POLB (0.45) LMNAPOLBSMN1; SMN2GBA2L3MBTL1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869032-B8 PYRIMIDINE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-03-25 EP disclosed
EP-1869032-A1 PYRIMIDINE DERIVATIVES FOR USE AS ANTICANCER AGENTS AstraZeneca AB (SE) 2007-12-26 EP disclosed
WO-2006106307-A1 PYRIMIDINE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2006-10-12 WO disclosed