SCHEMBL9135477

SCHEMBL9135477

C=CC(=O)NC(CC)C(OCCCC)OCCCC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.42
HPGD P15428 1/20 0.42
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
FAAH O00519 2/20 0.34
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
ACACB O00763 2/20 0.34
ATM Q13315 1/20 0.33
THRB P10828 3/20 0.33
THRA P10827 2/20 0.33
PLA2G2C Q5R387 1/20 0.33
MAPT P10636 1/20 0.33
RAB9A P51151 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
TGM2 P21980 1/20 0.32
ALDH1A1 P00352 1/20 0.32
CTSK P43235 1/20 0.31
CA1 P00915 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
SCHEMBL9138566 0.90 TSHR (0.41) TSHRHPGDZDHHC20ZDHHC2MAPK1
SCHEMBL3165262 0.83 TSHR (0.44) TSHRZDHHC20ZDHHC2MAPK1ACACB
SCHEMBL9139527 0.83 ZDHHC20 (0.39) TSHRHPGDZDHHC20ZDHHC2ACACB
SCHEMBL7170878 0.83 TSHR (0.43) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL7173862 0.83 TSHR (0.43) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL9138636 0.82 ZDHHC20 (0.41) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL5685783 0.80 TSHR (0.48) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL6904319 0.80 TSHR (0.47) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL18660323 0.80 TSHR (0.47) TSHRHPGDZDHHC20ZDHHC2FAAH
SCHEMBL11600754 0.79 TSHR (0.43) TSHRHPGDZDHHC20ZDHHC2FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5463007-A Aqueous, rapid curing, emulsion of vinyl acetate, vinyl acetate, ethylene, and an acrylamidobutyraldehyde acetal; coatings, binders, adhesives; waterproofing, adhesion, solvent resistance AIR PRODUCTS AND CHEMICALS, INC. (US) 1995-10-31 US disclosed
EP-0201693-B1 SELF- AND DIOL REACTIVE FORMALDEHYDE-FREE CROSSLINKING MONOMERS AND THEIR DERIVED POLYMERS AIR PRODUCTS AND CHEMICALS, INC. (US) 1991-11-27 EP disclosed
US-4864055-A ACETAL OF N-(OXOALKYL)ALKENAMIDE AIR PRODUCTS AND CHEMICALS, INC. (US) 1989-09-05 US disclosed
EP-0302521-A2 Nonwoven binder emulsions of vinyl acetate/ethylene copolymers having improved solvent resistance AIR PRODUCTS AND CHEMICALS, INC. (US) 1989-02-08 EP disclosed
US-4788288-A BINDERS; ADHESIVES; COATINGS FOR TEXTILE, PAPER AND CELLULOSE PRODUCTS; SOLVENT RESISTANCE AIR PRODUCTS AND CHEMICALS, INC. (US) 1988-11-29 US disclosed
US-4745025-A PREPARED IN PRESENCE OF POLYVINYL PYRROLIDONE AND CROSSLINKED WITH AMIDE AIR PRODUCTS AND CHEMICALS, INC. (US) 1988-05-17 US disclosed
US-4698384-A PREPARED IN THE PRESENCE OF POLYVINYL PYRROLIDONE AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-10-06 US disclosed
US-4691026-A Self- and hydroxyl reactive formaldehyde-free cyclic hemiamidal and hemiamide ketal crosslinking monomers AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-09-01 US disclosed
US-4663410-A Polymers of self- and hydroxyl reactive formaldehyde-free cyclic hemiamidal and hemiamide ketal crosslinking monomers AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-05-05 US disclosed
EP-0218827-A2 Polymers of self- and diol reactive formaldehyde-free crosslinking monomers AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-04-22 EP disclosed
EP-0215245-A1 Self- and hydroxyl reactive formaldehyde-free cyclic hemiamidal and hemiamide ketal crosslinking monomers and their derived polymers AIR PRODUCTS AND CHEMICALS, INC. (US) 1987-03-25 EP disclosed
EP-0201693-A2 Self- and diol reactive formaldehyde-free crosslinking monomers and their derived polymers AIR PRODUCTS AND CHEMICALS, INC. (US) 1986-11-20 EP disclosed