SCHEMBL8358232

SCHEMBL8358232

C=C(C)C(=O)OCCCNC(N)=S

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
THRB P10828 1/20 0.43
POLB P06746 1/20 0.39
APEX1 P27695 1/20 0.39
HTT P42858 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ALDH1A1 P00352 3/20 0.36
ACHE P22303 7/20 0.35
CA12 O43570 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
GAA P10253 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
SCHEMBL30484793 0.94 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL6064641 0.90 THRB (0.46) TSHRTHRBPOLBAPEX1HTT
SCHEMBL2462214 0.86 TSHR (0.53) TSHRTHRBPOLBAPEX1HTT
SCHEMBL15059598 0.83 TSHR (0.50) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16384923 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL2720435 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL16309330 0.82 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL24800694 0.82 TSHR (0.40) TSHRTHRBACHECA12CA1
SCHEMBL9421255 0.81 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT
SCHEMBL27776277 0.81 TSHR (0.56) TSHRTHRBPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5888719-A CONTINING A POLYMER; DARK DECAY STABILITY AGFA-GEVAERT AG (DE) 1999-03-30 US disclosed
US-5674668-A Photographic recording material AGFA-GEVAERT (DE) 1997-10-07 US disclosed
EP-0476117-B1 THERMOREVERSIBLE HEAT-THICKENING POLYACRYLAMIDES EASTMAN KODAK CO (US) 1997-02-19 EP disclosed
US-5518877-A POLYPEPTIDE-ADDITION POLYMER AGFA-GEVAERT AG (DE) 1996-05-21 US disclosed
US-5432245-A Casting layer of aqueous solution of polymer with hydrophobic units of N-/1,1-dimethyl-3-oxobutyl/acrylamide or an N-alkylacrylamide and hydrophilic units of another acrylamide, and heating to thicken and gel the layer EASTMAN KODAK COMPANY (US) 1995-07-11 US disclosed