SCHEMBL21950893

SCHEMBL21950893

CCOC(=O)C1=C(C(=O)OCC)C(C)(C)C=CC1(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 4/20 0.48
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA7 P43166 4/20 0.48
CA9 Q16790 4/20 0.48
CA14 Q9ULX7 4/20 0.48
ESR1 P03372 1/20 0.48
ESR2 Q92731 1/20 0.48
LMNA P02545 2/20 0.47
CYP1A2 P05177 2/20 0.47
CYP3A4 P08684 1/20 0.47
MAOA P21397 1/20 0.47
TSHR P16473 1/20 0.47
KDM4E B2RXH2 2/20 0.42
MAPT P10636 2/20 0.42
MEN1 O00255 1/20 0.42
ALOX15 P16050 1/20 0.42
KMT2A Q03164 1/20 0.42
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42

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
SCHEMBL11721465 0.80 MAPT (0.39) CA12CA1CA2CA7CA9
SCHEMBL21950904 0.80 KDM4E (0.46) CA12CA1CA2CA7CA9
SCHEMBL21950879 0.79 LMNA (0.45) CA12CA1CA2CA7CA9
SCHEMBL21950868 0.76 MAPT (0.44) CA12CA1CA2CA7CA9
SCHEMBL13996174 0.72 MAPT (0.41) CA12CA1CA2CA7CA9
SCHEMBL13234140 0.72 KDM4E (0.55) LMNATSHRKDM4EMAPTMEN1
SCHEMBL87450 0.72 CA1 (0.83) CA12CA1CA2CA7CA9
SCHEMBL7746905 0.70 CA1 (0.79) CA12CA1CA2CA7CA9
SCHEMBL21440358 0.70 CA1 (0.79) CA12CA1CA2CA7CA9
SCHEMBL29504635 0.70 CA1 (0.79) CA12CA1CA2CA7CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240182606-A1 METHOD FOR PRODUCING PROPYLENE COPOLYMER USING CATALYST SYSTEM HAVING IMPROVED COPOLYMERIZATION ACTIVITY HANWHA TOTALENERGIES PETROCHEMICAL CO., LTD. (KR) 2024-06-06 US disclosed
EP-4375303-A1 METHOD FOR PRODUCING PROPYLENE COPOLYMER USING CATALYST SYSTEM HAVING IMPROVED COPOLYMERIZATION ACTIVITY Hanwha TotalEnergies Petrochemical Co., Ltd. (KR) 2024-05-29 EP disclosed
US-20240158543-A1 Solid Catalyst For Producing Polypropylene And Method For Preparation Of Propylene-Derived Polymer HANWHA TOTALENERGIES PETROCHEMICAL CO., LTD. (KR) 2024-05-16 US disclosed
EP-4361186-A1 SOLID CATALYST FOR PRODUCING POLYPROPYLENE AND METHOD FOR PREPARATION OF PROPYLENE-DERIVED POLYMER Hanwha TotalEnergies Petrochemical Co., Ltd. (KR) 2024-05-01 EP disclosed
US-11434315-B2 Propylene polymerizing solid catalyst for reducing VOC and method of producing polypropylene using same HANWHA TOTAL PETROCHEMICAL CO., LTD. (KR) 2022-09-06 US disclosed
US-20200172641-A1 Propylene Polymerizing Solid Catalyst For Reducing VOC and Method Of Producing Polypropylene Using Same HANWHA TOTALENERGIES PETROCHEMICAL CO., LTD. (KR) 2020-06-04 US disclosed
EP-3653655-A1 PROPYLENE POLYMERIZING SOLID CATALYST FOR REDUCING VOC AND METHOD OF PRODUCING POLYPROPYLENE USING SAME Hanwha Total Petrochemical Co., Ltd. (KR) 2020-05-20 EP disclosed