SCHEMBL8633804

SCHEMBL8633804

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

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.47
ALOX15 P16050 1/20 0.47
BLM P54132 1/20 0.47
PMP22 Q01453 1/20 0.47
MMP2 P08253 2/20 0.39
MMP9 P14780 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
CA2 P00918 4/20 0.38
CA1 P00915 3/20 0.38
NOD1 Q9Y239 3/20 0.36
FOLH1 Q04609 2/20 0.36
RIMKLA Q8IXN7 1/20 0.36
NAALAD2 Q9Y3Q0 1/20 0.36
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
TGFBR1 P36897 1/20 0.35
GGH Q92820 1/20 0.35
BMP1 P13497 1/20 0.35

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
SCHEMBL2248015 0.84 KMT2A (0.44) KMT2AALOX15BLMPMP22MMP2
SCHEMBL7762307 0.84 KMT2A (0.44) KMT2AALOX15BLMPMP22MMP2
SCHEMBL3364509 0.82 KMT2A (0.42) KMT2AALOX15BLMPMP22MMP2
SCHEMBL5158281 0.82 KMT2A (0.42) KMT2AALOX15BLMPMP22MMP2
SCHEMBL27546760 0.81 KMT2A (0.50) KMT2AALOX15BLMPMP22MMP2
SCHEMBL15387335 0.81 KMT2A (0.50) KMT2AALOX15BLMPMP22MMP2
SCHEMBL28360583 0.81 KMT2A (0.41) KMT2AALOX15BLMPMP22MMP2
SCHEMBL1226605 0.79 KMT2A (0.47) KMT2AALOX15BLMPMP22MMP2
SCHEMBL1226603 0.79 KMT2A (0.47) KMT2AALOX15BLMPMP22MMP2
SCHEMBL28295732 0.79 KMT2A (0.52) KMT2AALOX15BLMPMP22MMP2

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
US-5776875-A Use of biodegradable polymers in preventing scale build-up NALCO CHEMICAL COMPANY (US) 1998-07-07 US claimed