SCHEMBL27746463

SCHEMBL27746463

C=CC(=O)NOC(=O)C=C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.40
ALDH1A1 P00352 7/20 0.40
MAPK1 P28482 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
FGFR4 P22455 1/20 0.36
TP53 P04637 3/20 0.36
HIF1A Q16665 3/20 0.36
CYP3A4 P08684 2/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPT P10636 1/20 0.32
CACNA1B Q00975 1/20 0.32
APBA1 Q02410 1/20 0.32
TGM2 P21980 5/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HPGD P15428 1/20 0.32
LMNA P02545 2/20 0.32
F13A1 P00488 1/20 0.30
TGM1 P22735 1/20 0.30
TGM3 Q08188 1/20 0.30
ZDHHC20 Q5W0Z9 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
SCHEMBL18839968 0.81
SCHEMBL190486 0.79
SCHEMBL21632368 0.79
SCHEMBL32691321 0.79 TSHR (0.43) TSHRALDH1A1MAPK1FGFR4TP53
SCHEMBL176518 0.79
SCHEMBL32691366 0.79 TSHR (0.43) TSHRALDH1A1MAPK1FGFR4TP53
SCHEMBL2365102 0.79
SCHEMBL5741244 0.77
SCHEMBL11507324 0.77
SCHEMBL7950676 0.77

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
CN-102471610-B Surface modification of polymer particles HEWLETT PACKARD DEVELOPMENT CO 2014-07-23 CN claimed
CN-111253533-A Silicone hydrogel composition, silicone hydrogel lens, and method for manufacturing silicone hydrogel lens 晶硕光学股份有限公司 2020-06-09 CN disclosed
CN-102712823-B Single batch latex ink compositions and methods HEWLETT-PACKARD DEVELOPMENT CO.,L.P. (US) 2014-10-01 CN disclosed
CN-102471610-B Surface modification of polymer particles HEWLETT PACKARD DEVELOPMENT CO 2014-07-23 CN disclosed
CN-102471610-A Surface modification of polymer particles HEWLETT PACKARD DEVELOPMENT CO 2012-05-23 CN disclosed
CN-101319027-B Method for preparing amphiprotic copolymer poly-dodecyl acrylic amide acrylic acid NORTHEAST ELECTRIC POWER UNIVERSITY 2011-06-15 CN disclosed
CN-101319027-A Method for preparing amphiprotic copolymer poly-dodecyl acrylic amide acrylic acid UNIV NORTHEAST ELECTRIC POWER (CN) 2008-12-10 CN disclosed