SCHEMBL7028882

SCHEMBL7028882

C=CCOC(=O)c1cccc(Cl)c1C(=O)OCC=C

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.65
ALDH1A1 P00352 3/20 0.56
TSHR P16473 1/20 0.56
HSD17B10 Q99714 1/20 0.56
HPGD P15428 2/20 0.46
CYP1A2 P05177 1/20 0.42
RHOA P61586 1/20 0.40
CXCR5 P32302 1/20 0.39
TXNRD1 Q16881 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
SNCA P37840 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
ALOX12 P18054 1/20 0.38
RAB9A P51151 1/20 0.38

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
SCHEMBL4439353 0.90 CYP3A4 (0.58) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL343095 0.89 CYP3A4 (0.76) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL9279951 0.85 CYP3A4 (0.71) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL4431185 0.85 CYP3A4 (0.77) CYP3A4ALDH1A1TSHRHSD17B10HPGD
Methane SCHEMBL10776015 0.84 CYP3A4 (0.74) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL8765881 0.83 ALDH1A1 (0.63) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL8766597 0.83 ALDH1A1 (0.59) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL11303033 0.83 CYP3A4 (0.67) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL9717642 0.81 CYP3A4 (0.69) CYP3A4ALDH1A1TSHRHSD17B10HPGD
SCHEMBL8788785 0.81 ALDH1A1 (0.74) CYP3A4ALDH1A1TSHRHSD17B10HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4771101-A Unsaturated polyesters colored with lignin EASTMAN KODAK COMPANY (US) 1988-09-13 US claimed
US-20030022105-A1 TWO -PHOTON UPCONVERTING DYES AND APPLICATIONS PRASAD PARAS N (US) 2003-01-30 US disclosed
US-6402037-B1 Two-photon upconverting dyes and applications THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK 2002-06-11 US disclosed
WO-2001037266-A9 THREE DIMENSIONAL DATA STORAGE DEVICE AND METHOD FOR READING UNIV NEW YORK STATE RES FOUND (US) 2002-05-23 WO disclosed
WO-2001037266-A1 THREE DIMENSIONAL DATA STORAGE DEVICE AND METHOD FOR READING THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 2001-05-25 WO disclosed
US-5912257-A COMPRISING A MATRIX AND STYRYL DYES AND CPOPOSITIONS SHOWING SUPERIOR TWO PHOTON ABSORPTION CROSS-SECTIONS; LASER COMPRISING SOUCE CAPABLE OF PRODUCING INFRARED RADIATION; MULTIPHASE MULTISTRUCTURAL COMPOSITES THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1999-06-15 US disclosed
EP-0862432-A1 TWO-PHOTON UPCONVERTING DYES AND APPLICATIONS THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1998-09-09 EP disclosed
WO-1997009043-A9 TWO-PHOTON UPCONVERTING DYES AND APPLICATIONS 1997-09-18 WO disclosed
WO-1997009043-A1 TWO-PHOTON UPCONVERTING DYES AND APPLICATIONS THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK (US) 1997-03-13 WO disclosed
EP-0274273-B1 Carboxyl modified olefinic copolymer composition UNIROYAL CHEM CO INC (US) 1996-08-28 EP disclosed
EP-0235198-A1 COLORED UNSATURATED POLYESTER MATERIAL CONTAINING COPOLYMERIZED METHINE DYES, AND PRODUCTS THEREFROM. EASTMAN KODAK CO (US) 1987-09-09 EP disclosed
WO-1987001121-A1 COLORED UNSATURATED POLYESTER MATERIAL CONTAINING COPOLYMERIZED METHINE DYES, AND PRODUCTS THEREFROM EASTMAN KODAK COMPANY (US) 1987-02-26 WO disclosed
EP-0079745-B1 FILAMENTARY RESIN COMPOSITIONS AND METHODS FOR MAKING SUCH COMPOSITIONS FORD MOTOR COMPANY LIMITED (GB) 1986-09-24 EP disclosed
US-4539390-A High molecular weight unsaturated polyesters of cyclohexanedimethanols EASTMAN KODAK COMPANY (US) 1985-09-03 US disclosed
EP-0079745-A1 Filamentary resin compositions and methods for making such compositions FORD MOTOR COMPANY LIMITED (GB) 1983-05-25 EP disclosed
US-4355136-A Solvent-resistant unsaturated polyester compositions EASTMAN KODAK COMPANY (US) 1982-10-19 US disclosed
US-4299927-A UNSATURATED POLYESTER AND A MODIFIED POLYOLEFIN EASTMAN KODAK COMPANY (US) 1981-11-10 US disclosed
US-4258143-A REACTION PRODUCT OF AN UNSATURATED POLYESTER AND A MODIFIED POLYOLEFIN EASTMAN KODAK COMPANY (US) 1981-03-24 US disclosed
US-4178263-A FREE RADICAL POLYMERIZATION CATALYSTS THE DOW CHEMICAL COMPANY (US) 1979-12-11 US disclosed
US-4131728-A Method for polymerizing olefinically unsaturated monomers employing a catalyst composition comprising (a) shock-sensitive organic peroxide and (b) an olefinic unsaturated non-homopolymerizable monomer THE DOW CHEMICAL COMPANY (US) 1978-12-26 US disclosed