SCHEMBL4707838

SCHEMBL4707838

[CH2]COc1ccc(OC[CH2])cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO1 P15559 1/20 0.47
TSHR P16473 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
KCNA3 P22001 1/20 0.36
APP P05067 1/20 0.36
LTA4H P09960 3/20 0.35
PRSS1 P07477 2/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
PTGS1 P23219 1/20 0.33
SLC6A2 P23975 1/20 0.33
CYP2C19 P33261 1/20 0.33
PTGS2 P35354 1/20 0.33
SLC6A3 Q01959 1/20 0.33
HIF1A Q16665 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
GAA P10253 2/20 0.32
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32

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
SCHEMBL535984 0.86 CA1 (0.58) TSHRTDP1APPGAACA12
SCHEMBL316199 0.86 MAOB (0.47) TDP1APPCYP1A2CYP2C19L3MBTL1
SCHEMBL535421 0.86 MAOB (0.47) APPLMNACYP1A2CYP2C19MAOB
SCHEMBL194336 0.86 LTA4H (0.52) APPLTA4HLMNACYP1A2PTGS1
SCHEMBL3156182 0.86 APP (0.56) NQO1APPCA1CA2CA9
SCHEMBL9664138 0.86 NQO1 (0.74) NQO1TSHRTDP1LTA4HPRSS1
SCHEMBL7470630 0.86 TDP1 (0.58) TSHRTDP1APPGAAL3MBTL1
SCHEMBL1224848 0.86 APP (0.47) APPLTA4HPTGS2CA12CA1
SCHEMBL535440 0.82 MAOB (0.53) CA12CA1CA2CA9MAPT
SCHEMBL3138590 0.82 SMN1; SMN2 (0.48) NQO1TDP1LMNACYP2C19L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0580726-B2 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY IMARX PHARMACEUTICAL CORP (US) 2008-08-20 EP claimed
EP-0804932-B1 Contrast media for diagnostic imaging comprising gas filled microspeures IMARX PHARMACEUTICAL CORP (US) 2001-05-16 EP claimed
EP-0580726-B1 LOW DENSITY MICROSPHERES AND THEIR USE AS CONTRAST AGENTS FOR COMPUTED TOMOGRAPHY IMARX PHARMACEUTICAL CORP (US) 1999-06-02 EP claimed
US-5442086-A Ultraviolet light-absorbing compounds and sunscreen formulations and polymeric materials containing such compounds or residues thereof EASTMAN CHEMICAL COMPANY (US) 1995-08-15 US claimed
US-5374419-A For solutions or suspensions that absorb both ultraviolet-A and-B wavelengths EASTMAN CHEMICAL COMPANY (US) 1994-12-20 US claimed
US-5302740-A Ultraviolet light-absorbing compounds and sunscreen formulations and polymeric materials containing such compounds or residues thereof EASTMAN KODAK COMPANY (US) 1994-04-12 US claimed
EP-0413648-B1 Ultraviolet light-absorbing compounds and sunscreen formulations and polymeric materials containing such compounds or residues thereof EASTMAN KODAK CO (US) 1994-02-16 EP claimed
EP-0471783-A1 POLYMETHINE COMPOUNDS, AND POLYMER COMPOSITIONS CONTAINING THEM EASTMAN KODAK COMPANY (US) 1992-02-26 EP claimed
US-4994512-A Photostabilizers for vecerage and food containers of polyesters or polycarbonate; ultraviolet radiation resistance EASTMAN KODAK COMPANY (US) 1991-02-19 US claimed
WO-1990013597-A1 POLYMETHINE COMPOUNDS, AND POLYMER COMPOSITIONS CONTAINING THEM EASTMAN KODAK COMPANY (US) 1990-11-15 WO claimed
EP-1039834-A4 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP (US) 2001-12-05 EP disclosed
EP-1046394-A2 Novel compositions useful for delivering compounds into a cell ImaRx Pharmaceutical Corp. (US) 2000-10-25 EP disclosed
EP-1039834-A1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP. (US) 2000-10-04 EP disclosed
US-6123923-A ADMINISTERING A PATIENT A CONTRAST AGENT CONTAINING A STABILIZER, A PHOTOACTIVE AGENT, A GASEOUS PRECURSOR SUCH AS PERFLUORINATED COMPOUND OR GAS OR BOTH, AND SCANNING THE PATIENT USING ULTRASOUND IMAGING AND OPTICAL IMAGING IMARX PHARMACEUTICAL CORP. (US) 2000-09-26 US disclosed
WO-1999030620-A1 OPTOACOUSTIC CONTRAST AGENTS AND METHODS FOR THEIR USE IMARX PHARMACEUTICAL CORP. (US) 1999-06-24 WO disclosed
EP-0471783-A1 POLYMETHINE COMPOUNDS, AND POLYMER COMPOSITIONS CONTAINING THEM EASTMAN KODAK COMPANY (US) 1992-02-26 EP disclosed
US-4994512-A Photostabilizers for vecerage and food containers of polyesters or polycarbonate; ultraviolet radiation resistance EASTMAN KODAK COMPANY (US) 1991-02-19 US disclosed
WO-1990013597-A1 POLYMETHINE COMPOUNDS, AND POLYMER COMPOSITIONS CONTAINING THEM EASTMAN KODAK COMPANY (US) 1990-11-15 WO disclosed
US-4749774-A UNSATURATED POLYESTERS EASTMAN KODAK COMPANY (US) 1988-06-07 US disclosed
US-4379912-A TRANSESTERIFICATION CATALYSTS EASTMAN KODAK COMPANY (US) 1983-04-12 US disclosed