SCHEMBL2836201

SCHEMBL2836201

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
HPGD P15428 2/20 0.40
TSHR P16473 1/20 0.39
KDM4E B2RXH2 3/20 0.39
GLA P06280 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
TDP1 Q9NUW8 2/20 0.38
EPHX2 P34913 2/20 0.38
NPC1 O15118 1/20 0.38
THRB P10828 1/20 0.38
RAB9A P51151 1/20 0.38
MAPK1 P28482 1/20 0.38
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
ATM Q13315 1/20 0.37
GAA P10253 1/20 0.36
ABCB11 O95342 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL21456865 1.00 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AHPGDTSHR
SCHEMBL16333302 1.00 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AHPGDTSHR
SCHEMBL17293736 1.00 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AHPGDTSHR
SCHEMBL2719858 1.00 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AHPGDTSHR
SCHEMBL11027269 1.00 SMN1; SMN2 (0.48) SMN1; SMN2MEN1KMT2AHPGDTSHR
SCHEMBL27160873 0.90 SMN1; SMN2 (0.44) SMN1; SMN2MEN1KMT2AHPGDTSHR
SCHEMBL9447837 0.89 MEN1 (0.52) SMN1; SMN2MEN1KMT2AKDM4EL3MBTL1
SCHEMBL8958237 0.89 MEN1 (0.52) SMN1; SMN2MEN1KMT2AKDM4EL3MBTL1
SCHEMBL8958557 0.89 MEN1 (0.52) SMN1; SMN2MEN1KMT2AKDM4EL3MBTL1
SCHEMBL8958401 0.89 MEN1 (0.52) SMN1; SMN2MEN1KMT2AKDM4EL3MBTL1

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
WO-2010030730-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-18 WO claimed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO claimed
WO-2009129395-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO claimed
WO-2010030730-A1 POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF ABBOTT LABORATORIES (US) 2010-03-18 WO disclosed
WO-2009129385-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129387-A2 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed
WO-2009129395-A1 CATIONIC LIPIDS AND USES THEREOF ABBOTT LABORATORIES (US) 2009-10-22 WO disclosed