SCHEMBL8993193

SCHEMBL8993193

CCC(O)CN(CNC(C)=O)CC(O)CC

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MAPK1 P28482 1/20 0.33
HIF1A Q16665 1/20 0.33
PAOX Q6QHF9 1/20 0.31
TSHR P16473 2/20 0.31
USP2 O75604 1/20 0.31
ALDH1A1 P00352 1/20 0.30
NPSR1 Q6W5P4 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
SCHEMBL8993367 0.81 CASP2 (0.39) L3MBTL1ALDH1A1
SCHEMBL8993376 0.78 KMT2A (0.37) KDM4EMAPK1HIF1APAOXTSHR
SCHEMBL81188 0.74 TSHR (0.39) L3MBTL1TSHR
SCHEMBL12845240 0.74 KDM4E (0.48) KDM4EMAPK1HIF1APAOXTSHR
SCHEMBL15829886 0.73 L3MBTL1 (0.42) L3MBTL1KDM4EMAPK1HIF1ATSHR
SCHEMBL17383672 0.73 L3MBTL1 (0.42) L3MBTL1KDM4EMAPK1HIF1ATSHR
SCHEMBL15835816 0.73
SCHEMBL16015603 0.73
SCHEMBL6636080 0.73
SCHEMBL16425174 0.72 KDM4E (0.42) KDM4EMAPK1HIF1APAOXTSHR

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
US-8187703-B2 Fiber-reinforced polymer composites containing functionalized carbon nanotubes WILLIAM MARSH RICE UNIVERSITY (US) 2012-05-29 US disclosed
US-20100143701-A1 Fiber-Reinforced Polymer Composites Containing Functionalized Carbon Nanotubes WILLIAM MARSH RICE UNIVERSITY 2010-06-10 US disclosed