SCHEMBL6929576

SCHEMBL6929576

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

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.33
PGR P06401 1/20 0.32
ADRA2A P08913 1/20 0.32
ADRA2B P18089 1/20 0.32
HTR2A P28223 1/20 0.32
HRH1 P35367 1/20 0.32
KCNH2 Q12809 1/20 0.32
FDPS P14324 1/20 0.32

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
SCHEMBL9004330 0.77 TDP1 (0.32) TSHR
SCHEMBL2543351 0.76 TSHR (0.34) TSHR
SCHEMBL6285016 0.75 TSHR (0.31) TSHR
SCHEMBL156098 0.74 TDP1 (0.36) TSHR
SCHEMBL11404332 0.72 TSHR (0.34) TSHRPGRADRA2AADRA2BHTR2A
SCHEMBL675175 0.72 TDP1 (0.35) TSHR
SCHEMBL4670578 0.71 PGR (0.41) TSHRPGRADRA2AADRA2BHTR2A
SCHEMBL2570923 0.71 TSHR (0.34) TSHR
SCHEMBL17350349 0.71 TDP1 (0.31) TSHR
SCHEMBL4497966 0.71 TSHR (0.35) TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6639029-B1 Atom trasfer radical polymerization of acrylate esters using copper metal catalyst; narrow molecular weight distribution; high molecular weight ROHMAX ADDITIVES GMBH (DE) 2003-10-28 US disclosed
US-6610801-B1 Acrylates with alkyl chains with at least 8 carbons; narrow molecular weight distribution; high molecular weight; ligands form a coordination compound with copper catalyst; initiator containing a transferable group (halide, sulfonyl halide) ROHMAX ADDITIVES GMBH (DE) 2003-08-26 US disclosed
US-6610802-B2 Polymerizing unsatd. monomers with a transition metal catalyst and a coordination compound-forming ligand; filtration using a filter aid having carboxylic acid-, sulfonic acid- or phosphonic acid-containing units ROHMAX ADDITIVES GMBH (DE) 2003-08-26 US disclosed
US-20030060587-A1 Process for synthesis of polymer compositions, polymer compositions obtainable by the process, and use of the same ROHMAX ADDITIVES GMBH (DE) 2003-03-27 US disclosed