SCHEMBL4879516

SCHEMBL4879516

O=C(O)C1(CC2CO2)CC=CCC1(CC1CO1)C(=O)O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL157692 0.78 CYP2C19 (0.33)
SCHEMBL19971067 0.74 MAPK1 (0.31)
SCHEMBL11779982 0.73
SCHEMBL28355203 0.73
SCHEMBL27757861 0.72
SCHEMBL27766096 0.71
SCHEMBL27383022 0.69 ALDH1A1 (0.30)
SCHEMBL420671 0.68 TP53 (0.33)
SCHEMBL15259589 0.68 ALDH1A1 (0.31)
SCHEMBL21950889 0.67 FFAR3 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644455-B1 ADHESION ENHANCING COATING COMPOSITION, PROCESS FOR USING AND COATED OR LAMINATED ARTICLES PRODUCED TRANSITIONS OPTICAL INC (US) 2016-05-11 EP claimed
US-7147889-B2 Organic photochromic compositions of improved kinetic performance TRANSITION OPTICAL, INC. (US) 2006-12-12 US claimed
EP-1340108-B9 ORGANIC PHOTOCHROMIC COMPOSITIONS OF IMPROVED KINETIC PERFORMANCE TRANSITIONS OPTICAL INC (US) 2006-08-23 EP claimed
EP-1340108-B1 ORGANIC PHOTOCHROMIC COMPOSITIONS OF IMPROVED KINETIC PERFORMANCE TRANSITIONS OPTICAL INC (US) 2006-03-15 EP claimed
US-20040149966-A1 Organic photochromic compositions of improved kinetic performance TRANSITIONS OPTICAL LIMITED (IE) 2004-08-05 US claimed
US-6713536-B2 ORGANIC POLYOL(S), EPOXY-CONTAINING COMPOUND(S) OR A MIXTURE IMPROVE THE PERFORMANCE OF ORGANIC PHOTOCHROMIC COMPOUNDS IN THE PLASTIC SUBSTRATE AS DETERMINED IN THE PHOTOCHROMIC PERFORMANCE TEST; OPTHALMALIC LENSES; PROTECTIVE DEVICES TRANSITIONS OPTICAL, INC. 2004-03-30 US claimed
US-6713530-B2 LIGHTFASTNESS, STABILITY TOWARDS POLLUTANTS, WATERFASTNESS AND RELIABILITY IN THE PRINT HEAD EASTMAN KODAK COMPANY 2004-03-30 US claimed
US-20030203989-A1 Article utilizing highly branched polymers to splay layered materials EASTMAN KODAK COMPANY 2003-10-30 US claimed
US-20030096885-A1 Ink jet ink composition EASTMAN KODAK COMPANY 2003-05-22 US claimed
US-20030092797-A1 Ink jet ink composition EASTMAN KODAK COMPANY 2003-05-15 US claimed
US-20030087990-A1 Ink jet printing method EASTMAN KODAK COMPANY 2003-05-08 US claimed
US-20030087987-A1 Ink jet printing method EASTMAN KODAK COMPANY 2003-05-08 US claimed
US-20030045612-A1 Organic photochromic compositions of improved kinetic performance TRANSITIONS OPTICAL LIMITED (IE) 2003-03-06 US claimed
US-6433043-B1 EPOXIDE; AND NAPHTHOPYRAN, QUINOPYRAN, INDENONAPHTHOPYRAN, PHENANTHROPYRAN, BENZOPYRAN, FULGIDES, FULGIMIDES, AND/OR METAL DITHIOZONATE PHOTOCHROMIC COMPOUND; OPHTHALMIC LENSES TRANSITIONS OPTICAL, INC. 2002-08-13 US claimed
US-5908723-A Recording sheets XEROX CORPORATION (US) 1999-06-01 US claimed
US-20080090918-A1 Separation medium, its preparation and its use PROTISTA BIOTECHNOLOGY AB (SE) 2008-04-17 US disclosed
US-20070167645-A1 Radiation-cured substances COGNIS IP MANAGEMENT GMBH (DE) 2007-07-19 US disclosed
US-5908723-A Recording sheets XEROX CORPORATION (US) 1999-06-01 US disclosed
EP-0126029-B1 IMAGE-FORMING PROCESS CIBA-GEIGY AG (CH) 1987-08-26 EP disclosed
EP-0126029-A2 Image-forming process CIBA-GEIGY AG (CH) 1984-11-21 EP disclosed