SCHEMBL8710828

SCHEMBL8710828

C=CCC(CC(=O)Cl)C(=O)Cl

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 2/20 0.39
GRIK2 Q13002 2/20 0.39
CPA1 P15085 1/20 0.38
CYP2C19 P33261 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
SCHEMBL29497160 0.85 GRIK1 (0.45) GRIK1GRIK2CPA1CYP2C19
SCHEMBL531800 0.84 GRIK1 (0.42) GRIK1GRIK2CPA1CYP2C19
SCHEMBL1741585 0.77 TSHR (0.32)
SCHEMBL8841243 0.75 GRIK1 (0.32) GRIK1GRIK2
SCHEMBL5805533 0.71 CA2 (0.44) GRIK1GRIK2CPA1
SCHEMBL360445 0.70 GRIK1 (0.35) GRIK1GRIK2CPA1CYP2C19
SCHEMBL563739 0.70
SCHEMBL29004325 0.69 CA2 (0.46) GRIK1GRIK2
SCHEMBL150292 0.69 TSHR (0.38)
SCHEMBL27789090 0.67 TSHR (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998054162-A1 PREPARATION OF ALKYL 4,5-DIHYDRO-η,5-DIOXO-2-ARYL-4-OXAZOLEBUTANOATES FINETECH LTD. (IL) 1998-12-03 WO claimed
WO-1998054162-A1 PREPARATION OF ALKYL 4,5-DIHYDRO-η,5-DIOXO-2-ARYL-4-OXAZOLEBUTANOATES FINETECH LTD. (IL) 1998-12-03 WO disclosed
WO-1998054162-A1 PREPARATION OF ALKYL 4,5-DIHYDRO-η,5-DIOXO-2-ARYL-4-OXAZOLEBUTANOATES FINETECH LTD. (IL) 1998-12-03 WO disclosed
US-4943646-A WITH N-ORGANOHYDROXAMIC ACID MONSANTO COMPANY (US) 1990-07-24 US disclosed
US-4939299-A Succinyl dihydroxamic acids MONSANTO COMPANY (US) 1990-07-03 US disclosed
EP-0271468-A2 Gallium complexes and solvent extraction of gallium Monsanto Company (US) 1988-06-15 EP disclosed
US-4741887-A Gallium complexes and solvent extraction of gallium MONSANTO COMPANY (US) 1988-05-03 US disclosed
US-3966801-A ANTIINFLAMMATORY AGENTS WILLIAM H. RORER, INC. (US) 1976-06-29 US disclosed