SCHEMBL296613

SCHEMBL296613

COc1ccc(C(=O)OOC(=O)c2ccc(OC)cc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 6/20 0.75
CA2 P00918 6/20 0.75
CES2 O00748 2/20 0.67
CES1 P23141 2/20 0.67
PARP10 Q53GL7 2/20 0.61
PARP1 P09874 1/20 0.61
PARP2 Q9UGN5 1/20 0.61
PARP4 Q9UKK3 1/20 0.61
MAPT P10636 3/20 0.58
MEN1 O00255 2/20 0.58
KMT2A Q03164 2/20 0.58
KDM4E B2RXH2 1/20 0.58
PLK1 P53350 1/20 0.57
GSK3B P49841 1/20 0.55
LMNA P02545 1/20 0.55
MAPK1 P28482 1/20 0.55
RAB9A P51151 1/20 0.55
NPSR1 Q6W5P4 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
HDAC3 O15379 1/20 0.55

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
SCHEMBL20446692 0.92 CA1 (0.64) CA1CA2CES2CES1PARP10
SCHEMBL7649401 0.92 CES2 (0.71) CA1CA2CES2CES1PARP10
SCHEMBL7636999 0.92 CA1 (0.64) CA1CA2CES2CES1PARP10
SCHEMBL7630206 0.90 CA1 (0.62) CA1CA2CES2CES1PARP10
SCHEMBL7637387 0.87 CA1 (0.64) CA1CA2CES2CES1PARP10
SCHEMBL7648706 0.87 CA1 (0.58) CA1CA2CES2CES1PARP10
SCHEMBL247019 0.86 CA1 (0.75) CA1CA2CES2CES1PARP10
Methyl 4-Methoxybenzoate SCHEMBL231243 0.86 CA1 (1.00) CA1CA2CES2CES1PARP10
SCHEMBL7625811 0.85 CA1 (0.56) CA1CA2CES2CES1PARP10
SCHEMBL7630702 0.85 CA1 (0.56) CA1CA2CES2CES1PARP10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7740826-B2 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2010-06-22 US claimed
US-20090306427-A1 Chemical Functionalization of Carbon Nanotubes NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2009-12-10 US claimed
EP-1989143-A1 CHEMICAL FUNCTIONALIZATION OF CARBON NANOTUBES National Research Council of Canada (CA) 2008-11-12 EP claimed
WO-2007098578-A1 CHEMICAL FUNCTIONALIZATION OF CARBON NANOTUBES NATIONAL RESEARCH COUNCIL OF CANADA (CA) 2007-09-07 WO claimed
US-20070098620-A1 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2007-05-03 US claimed
US-20040223900-A1 Method for functionalizing carbon nanotubes utilizing peroxides WILLIAM MARSH RICE UNIVERSITY (US) 2004-11-11 US claimed
EP-0438123-A2 Near infrared polymerization initiator SHOWA DENKO KABUSHIKI KAISHA (JP) 1991-07-24 EP claimed
US-4266055-A CHEMICAL INTERMEDIATE TO MERCAPTO PRODUCT NIPPON KASEI CHEMICAL CO., LTD. (JP) 1981-05-05 US claimed
US-RE28818-E WATER, REACTION PRODUCT OF PYROGENIC SILICA AND DIMETHYL DICHLOROSILANE AKZONA INCORPORATED (US) 1976-05-18 US claimed
US-6432543-B1 None US disclosed
WO-2025047768-A1 METHOD FOR PREPARING A POLYALLYL-FUNCTIONAL PREPOLYMER COMPOSITION, AND METHOD FOR MANUFACTURING AN OPTICAL ARTICLE WHEREIN SAID PREPOLYMER COMPOSITION IS USED MITSUI CHEMICALS, INC. (JP) 2025-03-06 WO disclosed
WO-2025023227-A1 METHOD FOR MANUFACTURING A POLYMERIC OPTICAL ARTICLE AND A COMPOSITION USED THEREFOR MITSUI CHEMICALS, INC. (JP) 2025-01-30 WO disclosed
US-11767395-B2 Polar functional non-aqueous acrylic dispersions SUN CHEMICAL CORPORATION (US) 2023-09-26 US disclosed
CN-115160203-A Continuous compounding method and device for benzoyl peroxide product 睦化(上海)流体工程有限公司 2022-10-11 CN disclosed
US-RE28818-E WATER, REACTION PRODUCT OF PYROGENIC SILICA AND DIMETHYL DICHLOROSILANE AKZONA INCORPORATED (US) 1976-05-18 US disclosed
US-3953393-A ALKYL MERCAPTAN CHAIN TRANSFERRING AGENT BASF WYANDOTTE CORPORATION (US) 1976-04-27 US disclosed
US-3950317-A FREE RADICAL CATALYSTS, VINYL MONOMERS, POLYOLS, POLYURETHANES BASF WYANDOTTE CORPORATION (US) 1976-04-13 US disclosed
US-RE28715-E UNSATURATED MONOMERS AND POLYOLS Stamberger, Paul (US) 1976-02-17 US disclosed
US-3931092-A FINELY-DIVIDED POLYMERIC SOLIDS HAVING IMPROVED PHYSICAL PROPERTIES BASF WYANDOTTE CORPORATION (US) 1976-01-06 US disclosed
US-3931450-A BONDING STRENGTH BASF WYANDOTTE CORPORATION (US) 1976-01-06 US disclosed