SCHEMBL2864349

SCHEMBL2864349

CC(=O)C(C(C)=O)C(=O)C(=O)[O-].CC(=O)C(C(C)=O)C(=O)C(=O)[O-].[Ni+2]

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA4 P22748 3/20 0.42
CA1 P00915 2/20 0.39
FAHD1 Q6P587 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
Zinc Ion SCHEMBL4238546 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL5160030 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL2233517 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL3630324 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL2342402 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL1525678 0.94 CA4 (0.42) CA4CA1FAHD1
SCHEMBL6263175 0.92 CA4 (0.40) CA4CA1FAHD1
SCHEMBL28886253 0.89 CA4 (0.38) CA4CA1
SCHEMBL29051218 0.87 CA4 (0.36) CA4CA1
SCHEMBL9446862 0.75 CA1 (0.44) CA4CA1

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
EP-1346971-B1 Production method for biarylalanine SUMITOMO CHEMICAL CO (JP) 2010-01-20 EP claimed
CN-115003760-A Curable polyorganosiloxane composition, cured product thereof, protective agent or adhesive, and electric/electronic device 陶氏东丽株式会社 2022-09-02 CN disclosed
CN-111770929-A Compositions and methods for treating CNS disorders 萨奇治疗股份有限公司 2020-10-13 CN disclosed
EP-0534582-B1 Methylation or ethylation agent and process for an 1,4-addition of a methyl- or ethylgroup to an alpha, beta-insaturated ketogroup SCHERING AG (DE) 1997-01-08 EP disclosed
WO-1993006066-A1 METHYLATING OR ETHYLATING AGENT AND PROCESS FOR 1,4-ADDING A METHYL OR ETHYL GROUP TO AN α,β-UNSATURATED KETO COMPOUND __ SCHERING AKTIENGESELLSCHAFT (DE) 1993-04-01 WO disclosed
EP-0534582-A1 Methylation or ethylation agent and process for an 1,4-addition of a methyl- or ethylgroup to an alpha, beta-insaturated ketogroup SCHERING AKTIENGESELLSCHAFT (DE) 1993-03-31 EP disclosed
EP-0219092-B1 PROCESS FOR PREPARING ALKENYLAROMATIC COMPOUNDS BASF Aktiengesellschaft (DE) 1989-10-04 EP disclosed
EP-0219092-A1 Process for preparing alkenylaromatic compounds BASF Aktiengesellschaft (DE) 1987-04-22 EP disclosed