SCHEMBL4027100

SCHEMBL4027100

CC(=O)N(CC1CC1)c1cnoc1C

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
RIPK1 Q13546 1/20 0.32
CHRNA4 P43681 1/20 0.32
KDM4E B2RXH2 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HDAC8 Q9BY41 1/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 1/20 0.30

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
SCHEMBL4027192 0.86 LMNA (0.35) LMNARIPK1
SCHEMBL6596993 0.75 NPC1 (0.35) LMNA
SCHEMBL4027824 0.74 LMNA (0.45) LMNARIPK1CHRNA4KDM4ETAS1R3
SCHEMBL1447502 0.73 HTT (0.40) LMNARIPK1CHRNA4KDM4EHSD17B10
SCHEMBL1447382 0.72 LMNA (0.54) LMNACHRNA4KDM4ETAS1R3TAS1R1
SCHEMBL4251064 0.71 LMNA (0.52) LMNAKDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL4247716 0.70 LMNA (0.41) LMNACHRNA4TAS1R3TAS1R1TAS1R2
SCHEMBL4020643 0.68 LMNA (0.37) LMNAKDM4E
SCHEMBL6594480 0.67 ALDH1A1 (0.34) LMNA
SCHEMBL3551490 0.67 TP53 (0.41) LMNAKDM4E

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
EP-1485375-B1 PYRIMIDINE COMPOUNDS ASTRAZENECA AB (SE) 2009-06-17 EP disclosed