SCHEMBL5832633

SCHEMBL5832633

CC(C)(CN)NC(CCC(N)=O)C(=O)O

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.41
ALOX15 P16050 1/20 0.41
BLM P54132 1/20 0.41
PMP22 Q01453 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MMP2 P08253 2/20 0.38
MMP9 P14780 2/20 0.38
CA2 P00918 5/20 0.38
CA1 P00915 4/20 0.38
FOLH1 Q04609 5/20 0.35
RIMKLA Q8IXN7 1/20 0.35
NAALAD2 Q9Y3Q0 1/20 0.35
GGH Q92820 1/20 0.34
BMP1 P13497 1/20 0.34
NOD1 Q9Y239 1/20 0.32

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
Hydrochloric Acid SCHEMBL821836 0.98 KMT2A (0.40) KMT2AALOX15BLMPMP22L3MBTL1
SCHEMBL2244574 0.86 KMT2A (0.41) KMT2AALOX15BLMPMP22L3MBTL1
SCHEMBL2247878 0.84 KMT2A (0.45) KMT2AALOX15BLMPMP22L3MBTL1
SCHEMBL20299077 0.84 KMT2A (0.45) KMT2AALOX15BLMPMP22L3MBTL1
SCHEMBL27967037 0.78 KMT2A (0.40) KMT2AALOX15BLMPMP22L3MBTL1
SCHEMBL2247130 0.77 KMT2A (0.48) KMT2AL3MBTL1MMP2MMP9CA2
Hydrochloric Acid SCHEMBL28131080 0.77 L3MBTL1 (0.39) KMT2AALOX15BLMPMP22L3MBTL1
SCHEMBL28434706 0.74 NOD1 (0.40) KMT2AALOX15BLMPMP22L3MBTL1
SCHEMBL2254027 0.74 MMP2 (0.47) KMT2AL3MBTL1MMP2MMP9CA2
SCHEMBL8139 0.74 KMT2A (0.50) KMT2AALOX15BLMPMP22L3MBTL1

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-1107707-B1 STENT COATING BOSTON SCIENT LTD (BB) 2006-11-29 EP claimed