SCHEMBL1763897

SCHEMBL1763897

CN(CCCCN)c1ccc2c(=O)[nH][nH]c(=O)c2c1

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.69
▸ TDP1 Q9NUW8 1/20 0.69
▸ MTNR1A P48039 2/20 0.35
▸ MTNR1B P49286 2/20 0.35
▸ NOS1 P29475 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ PRMT5 O14744 1/20 0.33
▸ WDR77 Q9BQA1 1/20 0.33
▸ PARP15 Q460N3 2/20 0.33
▸ PARP10 Q53GL7 2/20 0.33
▸ IP6K1 Q92551 1/20 0.33
▸ DAO P14920 3/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ METAP2 P50579 1/20 0.33
▸ NEK1 Q96PY6 1/20 0.32
▸ SYK P43405 1/20 0.32
▸ CHRM2 P08172 1/20 0.32

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
SCHEMBL437558 0.83 KDM4E (0.97) KDM4ETDP1PARP15PARP10DAO
SCHEMBL29394268 0.83 KDM4E (0.97) KDM4ETDP1PARP15PARP10DAO
SCHEMBL14321770 0.83 KDM4E (0.97) KDM4ETDP1PARP15PARP10DAO
SCHEMBL12955561 0.83 KDM4E (0.66) KDM4ETDP1PRMT5WDR77PARP15
SCHEMBL436768 0.82 KDM4E (1.00) KDM4ETDP1HSD17B10
SCHEMBL29421583 0.82 KDM4E (1.00) KDM4ETDP1HSD17B10
SCHEMBL19411235 0.79 KDM4E (0.88) KDM4ETDP1HSD17B10
SCHEMBL19692609 0.77 KDM4E (0.84) KDM4ETDP1PARP15PARP10HSD17B10
SCHEMBL29421600 0.75 KDM4E (0.80) KDM4ETDP1PARP15PARP10HSD17B10
SCHEMBL3075296 0.75 KDM4E (0.80) KDM4ETDP1PARP15PARP10HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3510404-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF Pharmakea, Inc. (US) 2019-07-17 — — EP claimed
US-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF PHARMAKEA, INC. 2019-06-27 — — US claimed
WO-2018048928-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 — — WO claimed
WO-1995029255-A1 LUMINESCENCE-BASED DIAGNOSTICS MEDILITE DIAGNOSTIKA (US) 1995-11-02 — — WO claimed
US-11879148-B2 Methods for detection, determination, and activity measurement of peroxidase based on chemiluminescence KYOTO LUMINOUS SCIENCE LABORATORY (JP) 2024-01-23 — — US disclosed
EP-3510404-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF Pharmakea, Inc. (US) 2019-07-17 — — EP disclosed
US-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF PHARMAKEA, INC. 2019-06-27 — — US disclosed
WO-2018048928-A1 CHEMICAL PROBES OF LYSYL OXIDASE-LIKE 2 AND USES THEREOF PHARMAKEA, INC. (US) 2018-03-15 — — WO disclosed
US-9034798-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CAPROTEC BIOANALYTICS GMBH (DE) 2015-05-19 — — US disclosed
US-8569481-B2 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions PHARMACEUTICALS, INC. (US) 2013-10-29 — — US disclosed
US-8268264-B2 Devices, systems and methods for separating magnetic particles CAPROTEC BIOANALYTICS GMBH (DE) 2012-09-18 — — US disclosed
US-20110118136-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions KOESTER HUBERT 2011-05-19 — — US disclosed
WO-2004064972-A2 CAPTURE COMPOUNDS, COLLECTIONS THEREOF AND METHODS FOR ANALYZING THE PROTEOME AND COMPLEX COMPOSITIONS HK PHARMACEUTICALS, INC. (US) 2004-08-05 — — WO disclosed
WO-2003077851-A9 COMPOUNDS AND METHODS FOR ANALYZING THE PROTEOME HK PHARMACEUTICALS INC (US) 2004-05-21 — — WO disclosed
WO-2003092581-A9 CAPTURE COMPOUNDS, COLLECTIONS THEREOF AND METHODS FOR ANALYZING THE PROTEOME AND COMPLEX COMPOSITIONS HK PHARMACEUTICALS INC (US) 2004-02-19 — — WO disclosed
WO-2003092581-A2 CAPTURE COMPOUNDS, COLLECTIONS THEREOF AND METHODS FOR ANALYZING THE PROTEOME AND COMPLEX COMPOSITIONS HK PHARMACEUTICALS, INC. (US) 2003-11-13 — — WO disclosed
WO-2003077851-A2 COMPOUNDS AND METHODS FOR ANALYZING THE PROTEOME HK PHARMACEUTICALS, INC. (US) 2003-09-25 — — WO disclosed
US-20030119021-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions CAPROTEC BIOANALYTICS GMBH (DE) 2003-06-26 — — US disclosed
US-5624813-A PEROXIDASES, OXIDOREDUCTASES MAHANT, VIJAY K. 1997-04-29 — — US disclosed
WO-1995029255-A1 LUMINESCENCE-BASED DIAGNOSTICS MEDILITE DIAGNOSTIKA (US) 1995-11-02 — — 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 (2 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-20110118136-A1 Capture compounds, collections thereof and methods for analyzing the proteome and complex compositions PTMS, QPCTL, SRMS KDM4E 1669/4885TDP1 2627/4885MTNR1A 4577/4885
US-20190192697-A1 CHEMICAL PROBES OF LYSYL OXIDASK-LIKE 2 AND USES THEREOF LOXL2, LOXL1, LOXL3 KDM4E 3469/4885TDP1 2058/4885MTNR1A 1522/4885

“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.

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