SCHEMBL13370331

SCHEMBL13370331

CCCC(C)(N)CCCN

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
EPHX1 P07099 1/20 0.39
FDPS P14324 4/20 0.36
KIF11 P52732 1/20 0.32
SMPD1 P17405 1/20 0.31
ODC1 P11926 1/20 0.31

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
SCHEMBL1276603 0.89 NFKB1 (0.38) DNM1MEN1KMT2ATSHRFDPS
SCHEMBL7053194 0.83 FDPS (0.41) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL18534230 0.83 FDPS (0.41) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL726014 0.83
SCHEMBL2545678 0.83
SCHEMBL28930138 0.82 DNM1 (0.50) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL23584949 0.81 FDPS (0.43) DNM1MEN1KMT2AALDH1A1TSHR
SCHEMBL3728122 0.81
SCHEMBL8369043 0.81 FDPS (0.43) DNM1MEN1KMT2AALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL29055682 0.80 FDPS (0.38) FDPS

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-2014285-B1 NPYY5 antagonists SHIONOGI & CO (JP) 2010-05-05 EP disclosed