SCHEMBL80414

SCHEMBL80414

[C-]#[N+]/C(C#N)=C1/C=C(C)OC(/C=C/c2ccccc2)=C1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.31
ALOX5 P09917 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 1/20 0.31

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
SCHEMBL12314020 1.00 TTR (0.31) TTRALOX5PTGS1PTGS2
SCHEMBL80521 0.91 MCL1 (0.35)
SCHEMBL1108163 0.90 NFE2L2 (0.31) ALOX5PTGS1PTGS2
SCHEMBL12160640 0.90 NFE2L2 (0.31) ALOX5PTGS1PTGS2
SCHEMBL12160621 0.89 MEN1 (0.32) TTRALOX5PTGS1PTGS2
SCHEMBL1108147 0.88 APP (0.33)
SCHEMBL13013115 0.86 PTGS1 (0.36) PTGS1PTGS2
SCHEMBL3412318 0.86 APP (0.39) PTGS1
SCHEMBL1108112 0.86 CYP1A2 (0.33)
SCHEMBL12640133 0.86 APP (0.39) PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12029796-B2 Fluorescent probes for silver ION detection THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2024-07-09 US disclosed
US-9919995-B2 Photoactivatable caged compounds with AIE characteristics: method of preparation and applications Tang, Benzhong (CN) 2018-03-20 US disclosed
US-9618453-B2 Aggregation induced emission of fluorescent bioprobes and methods of using the same THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2017-04-11 US disclosed
US-20160299078-A1 Specific Detection and Quantification of Cardiolipin and Isolated Mitochondria by Positively Charged AIE Fluorogens and Method of Manufacturing Thereof THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-10-13 US disclosed
US-9315465-B2 Photostable AIE luminogens for specific mitochondrial imaging and its method of manufacturing thereof THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-04-19 US disclosed
US-9279806-B2 Water-soluble AIE luminogens for monitoring and retardation of fibrillation of amyloid proteins THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-03-08 US disclosed
US-9228949-B2 Aggregation-induced emission luminogens for metal ion detection THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2016-01-05 US disclosed
US-20150376112-A1 Photoactivatable Caged Compounds with AIE Characteristics: Method of Preparation and Applications TANG, BENZHONG (HK) 2015-12-31 US disclosed
US-20150031607-A1 WATER-SOLUBLE AIE LUMINOGENS FOR MONITORING AND RETARDATION OF FIBRILLATION OF AMYLOID PROTEINS THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2015-01-29 US disclosed
US-20140212359-A1 PHOTOSTABLE AIE LUMINOGENS FOR SPECIFIC MITOCHONDRIAL IMAGING AND ITS METHOD OF MANUFACTURING THEREOF THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2014-07-31 US disclosed
US-8679738-B2 Water-soluble AIE luminogen for monitoring and retardation of amyloid fibrillation of insulin THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2014-03-25 US disclosed
US-20130266953-A1 AGGREGATION INDUCED EMISSION OF FLUORESCENT BIOPROBES AND METHODS OF USING THE SAME THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2013-10-10 US disclosed
US-20130059392-A1 AGGREGATION-INDUCED EMISSION LUMINOGENS FOR METAL ION DETECTION THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2013-03-07 US disclosed
US-20120172296-A1 WATER-SOLUBLE AIE LUMINOGEN FOR MONITORING AND RETARDATION OF AMYLOID FIBRILLATION OF INSULIN THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (HK) 2012-07-05 US disclosed
US-8129111-B2 Fluorescent water-soluable conjugated polyene compounds that exhibit aggregation induced emission and methods of making and using same THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2012-03-06 US disclosed
US-7939613-B2 Probes/sensors for biomacromolecules; films; cosmetics THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2011-05-10 US disclosed
US-20100009362-A1 Fluorescent water-soluable conjugated polyene compounds that exhibit aggregation induced emission and methods of making and using same THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2010-01-14 US disclosed
US-20080220407-A1 Fluorescent water-soluble conjugated polyene compounds that exhibit aggregation induced emission and methods of making and using same THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) 2008-09-11 US 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 (6 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-20140212359-A1 PHOTOSTABLE AIE LUMINOGENS FOR SPECIFIC MITOCHONDRIAL IMAGING AND ITS METHOD OF MANUFACTURING THEREOF MAVS, AIFM1, GSR TTR 397/4885ALOX5 4180/4885PTGS1 2436/4885
US-20150376112-A1 Photoactivatable Caged Compounds with AIE Characteristics: Method of Preparation and Applications TYR, S100A9, CENPE TTR 1292/4885ALOX5 4335/4885PTGS1 3991/4885
US-20130059392-A1 AGGREGATION-INDUCED EMISSION LUMINOGENS FOR METAL ION DETECTION PARN, IK, PARG TTR 131/4885ALOX5 4423/4885PTGS1 2704/4885
US-20120172296-A1 WATER-SOLUBLE AIE LUMINOGEN FOR MONITORING AND RETARDATION OF AMYLOID FIBRILLATION OF INSULIN IAPP, IGF2BP1, IGF2BP2 TTR 18/4885ALOX5 2402/4885PTGS1 1838/4885
US-20080220407-A1 Fluorescent water-soluble conjugated polyene compounds that exhibit aggregation induced emission and methods of making and using same FUS, CD63, EPCAM TTR 771/4885ALOX5 974/4885PTGS1 1591/4885
US-12029796-B2 Fluorescent probes for silver ION detection FUS, APC, ALB TTR 257/4885ALOX5 3862/4885PTGS1 3393/4885

“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.