SCHEMBL872574

SCHEMBL872574

CCCCc1cc(C(C)C(=O)OCC)cc(CCCC)c1O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EGFR P00533 1/20 0.40
PSEN1 P49768 1/20 0.40
PSEN2 P49810 1/20 0.40
APH1B Q8WW43 1/20 0.40
NCSTN Q92542 1/20 0.40
APH1A Q96BI3 1/20 0.40
PSENEN Q9NZ42 1/20 0.40
ALOX5 P09917 4/20 0.38
ESR1 P03372 3/20 0.38
FFAR1 O14842 1/20 0.38
MAOA P21397 1/20 0.38
PTGS2 P35354 3/20 0.37
TYR P14679 1/20 0.36
CNR2 P34972 3/20 0.35
KDM4E B2RXH2 1/20 0.35
NOD2 Q9HC29 1/20 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
SCHEMBL13145256 0.93 ESR1 (0.41) EGFRPSEN1PSEN2APH1BNCSTN
SCHEMBL328706 0.88 ALOX5 (0.41) EGFRPSEN1PSEN2APH1BNCSTN
SCHEMBL10272267 0.88 ALOX5 (0.41) EGFRPSEN1PSEN2APH1BNCSTN
SCHEMBL28006185 0.87 ESR1 (0.47) ALOX5ESR1PTGS2
SCHEMBL13180438 0.87 TDP1 (0.40) EGFRALOX5ESR1FFAR1MAOA
SCHEMBL29175219 0.87 EGFR (0.42) EGFRALOX5ESR1FFAR1MAOA
SCHEMBL10272893 0.83 EGFR (0.37) EGFRALOX5ESR1FFAR1MAOA
SCHEMBL328666 0.83 EGFR (0.37) EGFRALOX5ESR1FFAR1MAOA
SCHEMBL328642 0.83 EGFR (0.37) EGFRALOX5ESR1FFAR1MAOA
SCHEMBL872522 0.83 EGFR (0.43) EGFRALOX5FFAR1MAOAPTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143324-B2 antioxidants with hindered phenol functionality perform better in curing of polybenzocyclobutene materials in air without undue degradation of key properties DOW GLOBAL TECHNOLOGIES LLC (US) 2012-03-27 US disclosed
US-7807757-B2 stabilizing and at the same time phase compatibilizing plastics or plastic compositions by incorporating maleic anhydride or acrylic acid grafted copolymer or terpolymer (styrene/butadiene/styrene block copolymer grafted with maleic anhydride) obtained by reacting with a benzotriazole compound CIBA SPECIALTY CHEMICALS CORP. (US) 2010-10-05 US disclosed
US-20090275673-A1 Benzocyclobutene based polymer formulations and methods for processing such formulations in oxidative environments DOW GLOBAL TECHNOLOGIES LLC 2009-11-05 US disclosed
EP-2042547-A1 Benzocyclobutene based polymer formulations Dow Global Technologies Inc. (US) 2009-04-01 EP disclosed
US-20080051521-A1 Functionalized polymers PFAENDNER RUDOLF 2008-02-28 US disclosed