SCHEMBL80521

SCHEMBL80521

[C-]#[N+]C(C#N)=C1C=C(/C=C/c2ccccc2)OC(/C=C/c2ccccc2)=C1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 2/20 0.35
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
HPGD P15428 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP19A1 P11511 2/20 0.33
MAOA P21397 2/20 0.33
MAOB P27338 2/20 0.33
LMNA P02545 2/20 0.30
TRPA1 O75762 1/20 0.30
HTT P42858 1/20 0.30
MAPT P10636 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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 0.91 TTR (0.31)
SCHEMBL80414 0.91 TTR (0.31)
SCHEMBL10101118 0.89 APP (0.32) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL1108147 0.81 APP (0.33) CYP19A1MAOAMAOB
SCHEMBL16219560 0.81 ALDH1A1 (0.30) ALDH1A1MAPT
SCHEMBL28789994 0.80 MCL1 (0.40) MCL1KDM4EALDH1A1HPGDMEN1
SCHEMBL1108163 0.80 NFE2L2 (0.31) KDM4EMAPT
SCHEMBL12160640 0.80 NFE2L2 (0.31) KDM4EMAPT
SCHEMBL12391465 0.80 APP (0.30)
SCHEMBL10101114 0.80 APP (0.30)

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
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-8263018-B2 Detecting aggregation-induced emission via fluorescence THE HONG KONG UNIVERSITY OF SCIENCE AND TECHNOLOGY (HK) 2012-09-11 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 MCL1 250/4885KDM4E 2210/4885ALDH1A1 4054/4885
US-20150376112-A1 Photoactivatable Caged Compounds with AIE Characteristics: Method of Preparation and Applications TYR, S100A9, CENPE MCL1 1151/4885KDM4E 123/4885ALDH1A1 2112/4885
US-20130059392-A1 AGGREGATION-INDUCED EMISSION LUMINOGENS FOR METAL ION DETECTION PARN, IK, PARG MCL1 474/4885KDM4E 2151/4885ALDH1A1 2125/4885
US-20120172296-A1 WATER-SOLUBLE AIE LUMINOGEN FOR MONITORING AND RETARDATION OF AMYLOID FIBRILLATION OF INSULIN IAPP, IGF2BP1, IGF2BP2 MCL1 650/4885KDM4E 4534/4885ALDH1A1 3002/4885
US-20080220407-A1 Fluorescent water-soluble conjugated polyene compounds that exhibit aggregation induced emission and methods of making and using same FUS, CD63, EPCAM MCL1 925/4885KDM4E 4884/4885ALDH1A1 1173/4885
US-12029796-B2 Fluorescent probes for silver ION detection FUS, APC, ALB MCL1 106/4885KDM4E 4720/4885ALDH1A1 899/4885

“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.