SCHEMBL4513964

SCHEMBL4513964

CC(C)(C)OC(=O)COCCOCCOCCOCCOCCOCCNC(=O)OCc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.69
LMNA P02545 1/20 0.69
L3MBTL1 Q9Y468 2/20 0.52
MAPT P10636 2/20 0.51
IDO1 P14902 1/20 0.50
HTT P42858 1/20 0.49
SYK P43405 1/20 0.48
KEAP1 Q14145 2/20 0.46
NFE2L2 Q16236 2/20 0.46
TGM2 P21980 1/20 0.44
BCHE P06276 1/20 0.44
CNR2 P34972 1/20 0.44
SLC1A3 P43003 1/20 0.42
SLC1A1 P43005 1/20 0.42
ABCB1 P08183 1/20 0.42
CASP1 P29466 1/20 0.42

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
SCHEMBL20526175 1.00 SMN1; SMN2 (0.69) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL20136946 0.98 SMN1; SMN2 (0.68) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL25030665 0.92 LMNA (0.58) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL25030131 0.92 LMNA (0.62) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL5533423 0.91 LMNA (0.56) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL903459 0.91 LMNA (0.58) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL24572425 0.91 SMN1; SMN2 (0.69) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL18886286 0.91 SMN1; SMN2 (0.69) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL20107353 0.91 LMNA (0.61) SMN1; SMN2LMNAL3MBTL1MAPTIDO1
SCHEMBL25029156 0.90 LMNA (0.59) SMN1; SMN2LMNAL3MBTL1MAPTIDO1

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7494714-B2 Surfaces that resist the adsorption of biological species PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 2009-02-24 US disclosed
US-20070264505-A1 Resistant to the adsorption of proteins, cells and bacteria; have a chemical chain bonded thereon that comprise a terminal group free of a hydrogen bond donor or where a hydrogen bond donor is sufficiently buried PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2007-11-15 US disclosed
US-7276286-B2 Surfaces that resist the adsorption of biological species PRESIDENT & FELLOWS OF HARVARD COLLEGE (US) 2007-10-02 US disclosed
WO-2002006407-A9 SURFACES THAT RESIST THE ADSORPTION OF BIOLOGICAL SPECIES HARVARD COLLEGE (US) 2003-10-23 WO disclosed
EP-1301571-A2 SURFACES THAT RESIST THE ADSORPTION OF BIOLOGICAL SPECIES President And Fellows of Harvard College (US) 2003-04-16 EP disclosed
US-20020102405-A1 Surfaces that resist the adsorption of biological species NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2002-08-01 US disclosed
WO-2002006407-A2 SURFACES THAT RESIST THE ADSORPTION OF BIOLOGICAL SPECIES PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2002-01-24 WO disclosed