SCHEMBL6406501

SCHEMBL6406501

C=CC(=O)N(CC)CC(N)=O

nearest known ligand 0.39

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PSMB5 P28074 3/20 0.39
ZDHHC20 Q5W0Z9 2/20 0.38
ZDHHC2 Q9UIJ5 1/20 0.38
ALDH1A1 P00352 2/20 0.35
TSHR P16473 2/20 0.35
FGFR4 P22455 1/20 0.35
LMNA P02545 1/20 0.32
MMP1 P03956 1/20 0.31
MMP2 P08253 1/20 0.31
MMP3 P08254 1/20 0.31
MMP8 P22894 1/20 0.31
NPC1 O15118 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL8377943 0.84 ZDHHC20 (0.42) ZDHHC20ZDHHC2ALDH1A1TSHRFGFR4
Acrylamide SCHEMBL11604081 0.83 ALDH1A1 (0.50) PSMB5ZDHHC20ZDHHC2ALDH1A1TSHR
SCHEMBL14880 0.82
SCHEMBL8374055 0.81 ZDHHC20 (0.51) ZDHHC20ZDHHC2ALDH1A1TSHRMMP1
SCHEMBL8018156 0.81 PSMB5 (0.40) PSMB5ZDHHC20ZDHHC2ALDH1A1TSHR
SCHEMBL423989 0.80
SCHEMBL6401625 0.80 ZDHHC20 (0.39) PSMB5ZDHHC20ZDHHC2ALDH1A1TSHR
Ammonia Solution, Strong SCHEMBL28481040 0.80 ZDHHC20 (0.43) PSMB5ZDHHC20ZDHHC2ALDH1A1TSHR
SCHEMBL8373790 0.79 CA12 (0.39) ZDHHC20ZDHHC2ALDH1A1TSHRFGFR4
SCHEMBL25933346 0.78

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
US-20050075416-A1 Process for preparing microencapsulated pigment, microencapsulated pigment, aqueous dispersion, and ink for ink jet recording SEIKO EPSON CORPORATION 2005-04-07 US disclosed
US-5883211-A Thermoreversible hydrogels comprising linear copolymers and their use in electrophoresis ACLARA BIOSCIENCES, INC. (US) 1999-03-16 US disclosed
WO-1997040078-A1 THERMOREVERSIBLE HYDROGELS COMPRISING NON-CROSSLINKED COPOLYMERS AND THEIR USE IN ELECTROPHORESIS SOANE BIOSCIENCES (US) 1997-10-30 WO disclosed