SCHEMBL8996781

SCHEMBL8996781

CCOC(=O)c1ccc(C(=O)O)cc1.[KH]

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.68
CA2 P00918 3/20 0.68
CA12 O43570 2/20 0.68
CA7 P43166 2/20 0.68
CA9 Q16790 2/20 0.68
CA14 Q9ULX7 2/20 0.68
ESR1 P03372 1/20 0.68
ESR2 Q92731 1/20 0.68
LMNA P02545 1/20 0.66
CYP1A2 P05177 1/20 0.66
CYP3A4 P08684 1/20 0.66
MAOA P21397 1/20 0.66
MAPT P10636 2/20 0.61
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
HPGD P15428 4/20 0.58
HTT P42858 2/20 0.58
CYP2C9 P11712 1/20 0.58
CYP2C19 P33261 1/20 0.58
SMN1; SMN2 Q16637 4/20 0.57

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
Terephthalic Acid SCHEMBL28214245 0.98 CA1 (0.70) CA1CA2CA12CA7CA9
Terephthalic Acid SCHEMBL28214246 0.98 CA1 (0.70) CA1CA2CA12CA7CA9
SCHEMBL27063 0.98 CA1 (0.70) CA1CA2CA12CA7CA9
SCHEMBL10549946 0.96 CA1 (0.68) CA1CA2CA12CA7CA9
SCHEMBL11165649 0.96 CA1 (0.68) CA1CA2CA12CA7CA9
Benzene SCHEMBL28877605 0.96 CA1 (0.68) CA1CA2CA12CA7CA9
Benzoic Acid SCHEMBL29135370 0.92 SMN1; SMN2 (0.66) CA1CA2CA12CA7CA9
Dimethylamine SCHEMBL28980765 0.92 CA1 (0.63) CA1CA2CA12CA7CA9
SCHEMBL12446488 0.92 CA1 (0.63) CA1CA2CA12CA7CA9
Ethylene Glycol SCHEMBL29180203 0.92 CA1 (0.63) CA1CA2CA12CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024005446-A1 HYBRID DEPOLYMERIZATION OF POLYMER COMPRISING ESTER FUNCTIONAL GROUP, USING SOLVENT IN WHICH CARBONYL-BASED AND ALCOHOL-BASED COMPOUNDS ARE MIXED 한국화학연구원 2024-01-04 WO disclosed
EP-0724568-A1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER PLC (GB) 1996-08-07 EP disclosed
WO-1995003275-A1 AMIDO PEROXYCARBOXYLIC ACIDS FOR BLEACHING UNILEVER N.V. (NL) 1995-02-02 WO disclosed
US-5078907-A UNSYMMETRICAL DICARBOXYLIC ESTERS AS BLEACH PRECURSORS LEVER BROTHERS COMPANY, DIVISION OF CONOPCO, INC. (US) 1992-01-07 US disclosed
EP-0426217-A2 Bleach precursors UNILEVER N.V. (NL) 1991-05-08 EP disclosed
EP-0077202-B1 PROCESS FOR HYDROXYLATING OLEFINS USING OSMIUM-HALOGEN COMPOUND CATALYSTS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1986-04-09 EP disclosed
EP-0077201-B1 HYDROXYLATION OF OLEFINS EXXON RESEARCH AND ENGINEERING COMPANY (US) 1986-01-15 EP disclosed
EP-0160148-A1 Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper cocatalyst, and a cycloaliphatic amine based promoter EXXON RESEARCH AND ENGINEERING COMPANY (US) 1985-11-06 EP disclosed
US-4533773-A Process for hydroxylating olefins in the presence of an osmium oxide catalyst and carboxylate salt co-catalyst EXXON RESEARCH & ENGINEERING CO. (US) 1985-08-06 US disclosed
EP-0139498-A1 Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper co-catalyst, and an aromatic amine based promoter EXXON RESEARCH AND ENGINEERING COMPANY (US) 1985-05-02 EP disclosed
US-4496779-A Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper co-catalyst, and a cycloaliphatic amine based promoter EXXON RESEARCH & ENGINEERING CO. (US) 1985-01-29 US disclosed
US-4496778-A Process for the hydroxylation of olefins using molecular oxygen, an osmium containing catalyst, a copper Co-catalyst, and an aromatic amine based promoter EXXON RESEARCH & ENGINEERING CO. (US) 1985-01-29 US disclosed
US-4486613-A CATALYTIC OXIDATION EXXON RESEARCH & ENGINEERING CO. (US) 1984-12-04 US disclosed
EP-0102154-A1 Process for hydroxylating olefins using a supported osmium catalyst EXXON RESEARCH AND ENGINEERING COMPANY (US) 1984-03-07 EP disclosed
EP-0098701-A1 Process for hydroxylating olefins in the presence of an osmium oxide catalyst and carboxylate salt co-catalyst EXXON RESEARCH AND ENGINEERING COMPANY (US) 1984-01-18 EP disclosed
US-4413151-A WITH WATER AND OXIDIZER EXXON RESEARCH & ENGINEERING CO. (US) 1983-11-01 US disclosed
US-4390739-A Hydroxylation of olefins EXXON RESEARCH & ENGINEERING CO. (US) 1983-06-28 US disclosed
EP-0077202-A2 Process for hydroxylating olefins using osmium-halogen compound catalysts EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-04-20 EP disclosed
EP-0077201-A2 Hydroxylation of olefins EXXON RESEARCH AND ENGINEERING COMPANY (US) 1983-04-20 EP disclosed