SCHEMBL14403147

SCHEMBL14403147

C=C(C)[C@H](CCCC)NC

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.33
CYP3A4 P08684 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CA2 P00918 5/20 0.32
CA1 P00915 4/20 0.32
TSHR P16473 1/20 0.32
FDPS P14324 1/20 0.32
DNM1 Q05193 2/20 0.32
MAPK1 P28482 1/20 0.31
NOD1 Q9Y239 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
SCHEMBL24538485 0.93 LMNA (0.37) CYP3A4MEN1KMT2ACA1FDPS
SCHEMBL27412057 0.80 LMNA (0.37) CYP3A4MEN1KMT2A
SCHEMBL19577892 0.80 SIRT6 (0.32)
SCHEMBL19578139 0.80 KISS1R (0.40)
SCHEMBL20435343 0.78 SIRT6 (0.37) CA2CA1
SCHEMBL22504504 0.78 SLC15A1 (0.32) ALDH1A1CYP3A4CA2CA1TSHR
SCHEMBL25670865 0.78 SLC15A1 (0.32) ALDH1A1CYP3A4CA2CA1TSHR
SCHEMBL23903091 0.78 SIRT6 (0.37) CA2CA1
SCHEMBL23128301 0.78 HDAC4 (0.30)
SCHEMBL25862564 0.78 KISS1R (0.35)

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
WO-2016115168-A1 INCORPORATION OF UNNATURAL NUCLEOTIDES AND METHODS THEREOF Synthorx, Inc. (US) 2016-07-21 WO disclosed
WO-2007115182-A2 LINEAR NATRIURETIC PEPTIDE CONSTRUCTS PALATIN TECHNOLOGIES, INC. (US) 2007-10-11 WO disclosed