SCHEMBL4859249

SCHEMBL4859249

CC(=CCCCN(C)C)C(=O)O.CC(=CCCN(C)C)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.36
CD81 P60033 1/20 0.34
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 3/20 0.34
TDP1 Q9NUW8 1/20 0.34
PAOX Q6QHF9 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MEN1 O00255 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
KMT2A Q03164 1/20 0.33
EP300 Q09472 1/20 0.33
TBXAS1 P24557 1/20 0.33
KDM4A O75164 6/20 0.33
KDM4C Q9H3R0 6/20 0.33
KDM5A P29375 1/20 0.33
KDM7A Q6ZMT4 1/20 0.33
PHF8 Q9UPP1 1/20 0.33
KDM2A Q9Y2K7 1/20 0.33
BCL2L1 Q07817 1/20 0.33

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
SCHEMBL637089 0.96 USP2 (0.38) USP2CD81KDM4EALDH1A1TDP1
SCHEMBL23342 0.96 USP2 (0.38) USP2CD81KDM4EALDH1A1TDP1
Ammonia Solution, Strong SCHEMBL29268390 0.94 USP2 (0.37) USP2CD81KDM4EALDH1A1TDP1
SCHEMBL112617 0.92 CD81 (0.38) USP2CD81KDM4EALDH1A1TDP1
SCHEMBL22600 0.92 CD81 (0.38) USP2CD81KDM4EALDH1A1TDP1
SCHEMBL30875818 0.92 CD81 (0.38) USP2CD81KDM4EALDH1A1TDP1
SCHEMBL329006 0.90 ALDH1A1 (0.39) USP2KDM4EALDH1A1TDP1MEN1
SCHEMBL6065434 0.90 ALDH1A1 (0.39) USP2KDM4EALDH1A1TDP1MEN1
Bromide SCHEMBL1061720 0.90 CD81 (0.37) USP2CD81KDM4EALDH1A1TDP1
Hydrochloric Acid SCHEMBL966904 0.90 CD81 (0.37) USP2CD81KDM4AKDM4CBCL2L1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2008506794-A 2008-03-06 JP claimed
EP-1771532-A1 USE OF GRAFT POLYMERS Rohmax Additives GmbH (DE) 2007-04-11 EP claimed
WO-2006007934-A1 USE OF GRAFT POLYMERS ROHMAX ADDITIVES GMBH (DE) 2006-01-26 WO claimed