SCHEMBL434782

SCHEMBL434782

Cc1cc(C(C)(C)C)c([O])c(C(C)(C)C)c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.59
SMN1; SMN2 Q16637 5/20 0.59
CA2 P00918 2/20 0.59
TYR P14679 2/20 0.59
POLB P06746 1/20 0.59
HSPA5 P11021 1/20 0.46
CYP2C9 P11712 4/20 0.45
CYP2C19 P33261 3/20 0.45
HIF1A Q16665 3/20 0.45
CYP2D6 P10635 2/20 0.39
HSD17B10 Q99714 2/20 0.39
ALOX15 P16050 3/20 0.39
CYP1A2 P05177 2/20 0.39
KDM4E B2RXH2 2/20 0.39
MAPT P10636 1/20 0.39
ATP2A2 P16615 1/20 0.39
ATP2A3 Q93084 1/20 0.39
CA1 P00915 1/20 0.36
TSHR P16473 3/20 0.35
TDP1 Q9NUW8 2/20 0.35

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
SCHEMBL2909254 0.87 SMN1; SMN2 (0.52) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL7033950 0.81 SMN1; SMN2 (0.46) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL2864273 0.81 HSPA5 (0.62) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL4658904 0.79 SMN1; SMN2 (0.45) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL7047479 0.79 ALDH1A1 (0.62) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL1171494 0.77 GABRA1 (0.43) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL4452394 0.74 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL1930777 0.74 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL10660854 0.74 PTGDR2 (0.39) ALDH1A1SMN1; SMN2CA2TYRPOLB
SCHEMBL4452398 0.74 ALDH1A1 (0.56) ALDH1A1SMN1; SMN2CA2TYRPOLB

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 555 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115260353-B Acrylic ester polymerization reaction method based on synergistic regulation and control of hydrogen bond and Lewis acid 青岛大学 2023-08-15 CN claimed
CN-115322231-A Oxazoline-based N, N-bidentate iron complex, preparation method and application 大连理工大学 2022-11-11 CN claimed
CN-115260353-A Acrylate polymerization reaction method based on cooperative regulation and control of hydrogen bond and Lewis acid 青岛大学 2022-11-01 CN claimed
CN-113754805-A Rare earth catalyst and preparation and application thereof 中国科学院大连化学物理研究所 2021-12-07 CN claimed
CN-111715293-A Complex used as active component in supported type epoxidation catalyst 利安德化学技术有限公司 2020-09-29 CN claimed
EP-3662996-A2 MOLYBDENUM AND TUNGSTEN COMPLEXES AS OLEFIN METATHESIS CATALYSTS AND REACTIONS USING THE CATALYSTS Verbio Vereinigte BioEnergie AG (DE) 2020-06-10 EP claimed
EP-3559087-A1 METHOD FOR LOWERING THE CRYSTALLIZATION TEMPERATURE OF SEMICRYSTALLINE POLYAMIDES, POLYAMIDE MOLDING COMPOUND PRODUCED THEREBY, AND USE OF ORGANIC PHOSPHORUS COMPOUNDS TO LOWER THE CRYSTALLIZATION TEMPERATURE Fraunhofer Gesellschaft zur Förderung der Angewand (DE) 2019-10-30 EP claimed
EP-2703081-B1 MOLYBDENUM AND TUNGSTEN COMPLEXES AS OLEFIN METATHESIS CATALYSTS AND REACTIONS USING THE CATALYSTS XIMO AG (CH) 2019-08-07 EP claimed
US-9919299-B2 Metathesis catalysts and reactions using the catalysts XIMO AG (CH) 2018-03-20 US claimed
EP-3169436-A2 COMPLEXES USEFUL AS ACTIVE COMPONENTS IN SUPPORTED EPOXIDATION CATALYSTS Lyondell Chemical Technology, L.P. (US) 2017-05-24 EP claimed
EP-1105398-B1 ACTIVATOR COMPOSITION COMPRISING ALUMINUM COMPOUND MIXTURE DOW CHEMICAL CO (US) 2002-07-17 EP claimed
EP-1105398-A1 ACTIVATOR COMPOSITION COMPRISING ALUMINUM COMPOUND MIXTURE THE DOW CHEMICAL COMPANY (US) 2001-06-13 EP claimed
EP-1105397-A1 THREE COORDINATE ALUMINUM CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2001-06-13 EP claimed
US-6211111-B1 Activator composition comprising aluminum compound mixture THE DOW CHEMICAL COMPANY 2001-04-03 US claimed
US-6187940-B1 A FLUORINATED AROMATIC HYDROCARBYL ALUMINUM COMPOUND USE AS ACTIVATORS FOR ACTIVATION OF METAL COMPLEXES IN OLEFIN POLYMERIZATIONS; IMPROVED EFFICIENCY AND OPERABILITY THE DOW CHEMICAL COMPANY 2001-02-13 US claimed
WO-2000009514-A1 ACTIVATOR COMPOSITION COMPRISING ALUMINUM COMPOUND MIXTURE THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO claimed
WO-2000009513-A1 THREE COORDINATE ALUMINUM CATALYST ACTIVATOR COMPOSITION THE DOW CHEMICAL COMPANY (US) 2000-02-24 WO claimed
US-5294737-A Hydrolysis, cyclization, condensation THE RESEARCH FOUNDATION STATE UNIVERSITY OF NEW YORK (US) 1994-03-15 US claimed
US-4593111-A Silyl isothiocyanates JOHN WYETH & BROTHER LTD. (GB) 1986-06-03 US claimed
US-4315836-A MAGNESIUM DIHALIDE, ORGANDALUMINUM COMPOUND AND AN ELECTRON PONOR COMPONENT MONTEDISON, S.P.A. (IT) 1982-02-16 US claimed