SCHEMBL1618632

SCHEMBL1618632

CCCCOc1ccc(C=Cc2ccccc2)cc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RELA Q04206 1/20 0.72
CHRNA7 P36544 9/20 0.68
CYP1A2 P05177 2/20 0.68
KDM4E B2RXH2 2/20 0.68
ALDH1A1 P00352 2/20 0.68
MAPT P10636 1/20 0.68
MEN1 O00255 1/20 0.68
TP53 P04637 1/20 0.68
CYP2D6 P10635 1/20 0.68
HPGD P15428 1/20 0.68
ALOX15 P16050 1/20 0.68
KMT2A Q03164 1/20 0.68
HSD17B10 Q99714 1/20 0.68
CHRNA10 Q9GZZ6 5/20 0.67
CHRNA9 Q9UGM1 5/20 0.67
CHRNB4 P30926 4/20 0.67
CHRNA3 P32297 4/20 0.67
CHRNB2 P17787 1/20 0.66
APOBEC3A P31941 1/20 0.66
CHRNA4 P43681 1/20 0.66

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
SCHEMBL5741015 1.00 RELA (0.72) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL5739190 0.95 CHRNA7 (0.68) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL5740096 0.95 CHRNA7 (0.68) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL5739187 0.95 CHRNA7 (0.68) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL7538209 0.95 CHRNA7 (0.68) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL5740101 0.95 CHRNA7 (0.68) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL2622559 0.93 CHRNA7 (0.63) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL9915594 0.92 AHR (0.73) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL2622567 0.90 CHRNA7 (0.64) RELACHRNA7CYP1A2KDM4EALDH1A1
SCHEMBL2622588 0.90 CHRNA7 (0.64) RELACHRNA7CYP1A2KDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487936-B1 NON-VISUALIZED PERMANENT INFORMATION RECORDING SUBSTRATE FOR USE AS SECURITY LABEL FOR AUTHENTICATION COUNCIL SCIENT IND RES (IN) 2006-09-06 EP claimed
EP-1487936-A1 NON-VISUALIZED PERMANENT INFORMATION RECORDING SUBSTRATE FOR USE AS SECURITY LABEL FOR AUTHENTICATION COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-12-22 EP claimed
WO-2003080759-A1 NON-VISUALIZED PERMANENT INFORMATION RECORDING SUBSTRATE FOR USE AS SECURITY LABEL FOR AUTHENTICATION COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2003-10-02 WO claimed
US-7923193-B2 Photopolymerizable composition AGFA GRAPHICS NV (BE) 2011-04-12 US disclosed
US-20110065042-A1 PHOTOPOLYMERIZABLE COMPOSITION AGFA GRAPHICS NV (BE) 2011-03-17 US disclosed
US-20110059398-A1 PHOTOPOLYMERIZABLE COMPOSITION AGFA GRAPHICS NV (BE) 2011-03-10 US disclosed
US-7767382-B2 Method of making a photopolymer printing plate AGFA GRAPHICS NV (BE) 2010-08-03 US disclosed
US-7749683-B2 Photopolymerizable composition AGFA GRAPHICS NV (BE) 2010-07-06 US disclosed
US-20090111052-A1 PHOTOPOLYMERIZABLE COMPOSITION AGFA GRAPHICS NV (BE) 2009-04-30 US disclosed
US-20090104562-A1 PHOTOPOLYMERIZABLE COMPOSITION AGFA GRAPHICS NV (BE) 2009-04-23 US disclosed
US-20080311509-A1 Photopolymer Printing Plate Precursor AGFA GRAPHICS NV (BE) 2008-12-18 US disclosed
US-7439537-B2 Divinylfluorenes AGFA GRAPHICS, N.V. (BE) 2008-10-21 US disclosed
US-7241557-B2 Printing plate precursor, sensitivity AGFA GRAPHICS NV (BE) 2007-07-10 US disclosed
US-20060022193-A1 Divinylfluorenes AGFA-GEVAERT (BE) 2006-02-02 US disclosed
US-20060024614-A1 Photopolymerizable composition AGFA-GEVAERT (BE) 2006-02-02 US disclosed
US-20050266349-A1 Method of making a photopolymer printing plate AGFA-GEVAERT (BE) 2005-12-01 US disclosed
US-6951692-B1 Fluorescent compounds dispersed in polymer films, and coated on metals, glass or polymer sheets having codes recorded by masking; counterfeiting prevention COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2005-10-04 US disclosed
EP-1487936-A1 NON-VISUALIZED PERMANENT INFORMATION RECORDING SUBSTRATE FOR USE AS SECURITY LABEL FOR AUTHENTICATION COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2004-12-22 EP disclosed
WO-2003080759-A1 NON-VISUALIZED PERMANENT INFORMATION RECORDING SUBSTRATE FOR USE AS SECURITY LABEL FOR AUTHENTICATION COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2003-10-02 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060022193-A1 Divinylfluorenes DNER, DLK1, TRPA1 RELA 2724/4885CHRNA7 1490/4885CYP1A2 1757/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.