SCHEMBL1298995

SCHEMBL1298995

CC/C(C)=C/CC/C(C)=C/CCC(C)=O

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.50
KDM4E B2RXH2 1/20 0.47
ATM Q13315 1/20 0.47
FNTA P49354 3/20 0.46
FNTB P49356 3/20 0.46
POLB P06746 1/20 0.45
MAPT P10636 3/20 0.45
ALOX15 P16050 3/20 0.45
MEN1 O00255 3/20 0.45
ALDH1A1 P00352 2/20 0.45
CYP3A4 P08684 2/20 0.45
UGT1A1 P22309 1/20 0.45
KDM1A O60341 1/20 0.44
SQLE Q14534 1/20 0.43
TRPA1 O75762 1/20 0.42

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
SCHEMBL1298997 1.00 KMT2A (0.50) KMT2AKDM4EATMFNTAFNTB
SCHEMBL5188887 0.95 KDM4E (0.45) KMT2AKDM4EATMFNTAFNTB
SCHEMBL3019152 0.95 KDM4E (0.45) KMT2AKDM4EATMFNTAFNTB
SCHEMBL3019155 0.95 KDM4E (0.45) KMT2AKDM4EATMFNTAFNTB
SCHEMBL25236755 0.86 KMT2A (0.50) KMT2AKDM4EATMFNTAFNTB
SCHEMBL25232929 0.86 KMT2A (0.50) KMT2AKDM4EATMFNTAFNTB
SCHEMBL11652149 0.86 KMT2A (0.50) KMT2AKDM4EATMFNTAFNTB
SCHEMBL10663274 0.85 FNTA (0.40) KMT2AKDM4EATMFNTAFNTB
SCHEMBL31619094 0.85 KDM4E (0.68) KMT2AKDM4EATMFNTAFNTB
SCHEMBL11280546 0.85 FNTA (0.40) KMT2AKDM4EATMFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024053903-A1 ELECTRONIC NOSE SENSOR FOR DIAGNOSING LUNG CANCER, AND ELECTRONIC NOSE SYSTEM FOR DIAGNOSING LUNG CANCER USING SAME 주식회사 젠라이프 2024-03-14 WO claimed
US-20210186367-A1 SYSTEM FOR DETECTION OF VOLATILE ORGANIC COMPOUNDS (VOC) IN EXHALED BREATH FOR HEALTH MONITORING KOZHNOSYS PRIVATE LIMITED (IN) 2021-06-24 US claimed
EP-3101422-B1 DETECTION OF CANCER THROUGH BREATH COMPRISING A SENSOR ARRAY COMPRISING CAPPED CONDUCTIVE NANOPARTICLES TECHNION RES & DEV FOUNDATION (IL) 2018-11-28 EP claimed
US-9696311-B2 Detection of cancer through breath comprising a sensor array comprising capped conductive nanoparticles TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2017-07-04 US claimed
EP-3101422-A1 DETECTION OF CANCER THROUGH BREATH COMPRISING A SENSOR ARRAY COMPRISING CAPPED CONDUCTIVE NANOPARTICLES Technion Research & Development Foundation Ltd. (IL) 2016-12-07 EP claimed
EP-2376913-B1 DETECTION OF CANCER THROUGH BREATH COMPRISING A SENSOR ARRAY COMPRISING CAPPED CONDUCTIVE NANOPARTICLES TECHNION RES & DEV FOUNDATION (IL) 2016-06-29 EP claimed
US-8597953-B2 Volatile organic compounds as diagnostic markers in the breath for lung cancer TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2013-12-03 US claimed
US-20110277538-A1 Volatile Organic Compounds as Diagnostic Markers in the Breath for Lung Cancer TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2011-11-17 US claimed
US-20110269632-A1 Detection of Cancer through Breath Comprising a Sensor Array Comprising Capped Conductive Nanoparticles TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2011-11-03 US claimed
EP-2376913-A1 DETECTION OF CANCER THROUGH BREATH COMPRISING A SENSOR ARRAY COMPRISING CAPPED CONDUCTIVE NANOPARTICLES Technion Research and Development Foundation, Ltd. (IL) 2011-10-19 EP claimed
WO-2010079491-A1 VOLATILE ORGANIC COMPOUNDS AS DIAGNOSTIC MARKERS IN THE BREATH FOR LUNG CANCER TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2010-07-15 WO claimed
WO-2010079490-A1 VOLATILE ORGANIC COMPOUNDS AS DIAGNOSTIC MARKERS IN THE BREATH FOR LUNG CANCER TECHNION RESEARCH AND DEVELOPMENT FOUNDATION LTD. (IL) 2010-07-15 WO claimed
US-20240225477-A9 SYSTEM FOR DETECTION OF VOLATILE ORGANIC COMPOUNDS (VOC) IN EXHALED BREATH FOR HEALTH MONITORING KOZHNOSYS PRIVATE LIMITED (IN) 2024-07-11 US disclosed
US-20240206762-A1 SYSTEM FOR DETECTION OF VOLATILE ORGANIC COMPOUNDS (VOC) IN EXHALED BREATH FOR HEALTH MONITORING KOZHNOSYS PRIVATE LIMITED (IN) 2024-06-27 US disclosed
US-20240130632-A1 SYSTEM FOR DETECTION OF VOLATILE ORGANIC COMPOUNDS (VOC) IN EXHALED BREATH FOR HEALTH MONITORING KOZHNOSYS PRIVATE LTD (IN) 2024-04-25 US disclosed
WO-2024053903-A1 ELECTRONIC NOSE SENSOR FOR DIAGNOSING LUNG CANCER, AND ELECTRONIC NOSE SYSTEM FOR DIAGNOSING LUNG CANCER USING SAME 주식회사 젠라이프 2024-03-14 WO disclosed
WO-2009091375-A2 RAPID DETECTION OF VOLATILE ORGANIC COMPOUNDS FOR IDENTIFICATION OF BACTERIA IN A SAMPLE THE CHARLES STARK DRAPER LABORATORY, INC. (US) 2009-07-23 WO disclosed
US-7544647-B1 Aldehydes and derivatives for fragrance use INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2009-06-09 US disclosed
US-7544647-B1 Aldehydes and derivatives for fragrance use INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 2009-06-09 US disclosed
WO-2009054913-A1 RAPID DETECTION OF VOLATILE ORGANIC COMPOUNDS FOR IDENTIFICATION OF BACTERIA IN A SAMPLE THE CHARLES STARK DRAPER LABORATORY, INC. (US) 2009-04-30 WO disclosed