SCHEMBL166772

SCHEMBL166772

NC(=O)CC[C@H](N)C(=O)Nc1ccc2ccccc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.50
KMT2A Q03164 4/20 0.50
MAPT P10636 3/20 0.50
CYP1A2 P05177 3/20 0.50
POLB P06746 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
LTA4H P09960 2/20 0.49
RAB9A P51151 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
GAA P10253 1/20 0.49
KDM4E B2RXH2 1/20 0.48
ALDH1A1 P00352 1/20 0.48
CYP2C19 P33261 1/20 0.48
HIF1A Q16665 1/20 0.48
NPC1 O15118 3/20 0.48
LMNA P02545 4/20 0.47
ROCK2 O75116 2/20 0.46
CMA1 P23946 2/20 0.45
SLC1A3 P43003 1/20 0.45
SLC1A2 P43004 1/20 0.45

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
SCHEMBL21753952 1.00 MEN1 (0.50) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL29395053 0.89 LTA4H (0.62) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL9393008 0.86 RAB9A (0.55) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL8362464 0.83 LTA4H (0.56) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL20353588 0.83 ROCK2 (0.60) ROCK2ROCK1
SCHEMBL25266534 0.82 MEN1 (0.55) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL4609213 0.82 MEN1 (0.55) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL30427471 0.82 MEN1 (0.55) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL7618233 0.82 LTA4H (0.61) MEN1KMT2AMAPTCYP1A2POLB
SCHEMBL15465921 0.81 MAPT (0.62) MEN1KMT2AMAPTCYP1A2POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2432314-B1 MOUSE MODELS CARRYING A KNOCK-OUT MUTATION OF THE QPCTL-GENE PROBIODRUG AG (DE) 2017-12-20 EP disclosed
US-9462793-B2 Mouse carrying a knock-out mutation of the Qpct-gene PROBIODRUG AG (DE) 2016-10-11 US disclosed
US-9277737-B2 Mouse models carrying a knock-out mutation of the QPCTL-gene PROBIODRUG AG (DE) 2016-03-08 US disclosed
US-20150150225-A1 TRANSGENIC MOUSE EXPRESSING HUMAN ISOGLUTAMINYL CYCLOTRANSFERASE PROBIODRUG, AG (DE) 2015-06-04 US disclosed
US-20130291133-A1 MOUSE MODELS CARRYING A KNOCK-OUT MUTATION OF THE QPCTL-GENE PROBIODRUG AG (DE) 2013-10-31 US disclosed
EP-2238252-B1 MOUSE MODELS CARRYING A KNOCK-OUT MUTATION OF THE GLUTAMINYL CYCLASE GENE PROBIODRUG AG (DE) 2013-07-31 EP disclosed
US-20120070444-A1 IN VIVO SCREENING MODELS FOR TREATMENT OF isoQC-RELATED DISORDERS PROBIODRUG AG (DE) 2012-03-22 US disclosed
US-8138311-B2 Modified proteins, designer toxins, and methods of making thereof RESEARCH DEVELOPMENT FOUNDATION (US) 2012-03-20 US disclosed
WO-2012028706-A1 IN VIVO SCREENING MODELS FOR TREATMENT OF isoQC-RELATED DISORDERS PROBIODRUG AG (DE) 2012-03-08 WO disclosed
EP-2395095-A1 In vivo screening models for treatment of Alzheimer's disease and other QPCT-related disorders Probiodrug AG (DE) 2011-12-14 EP disclosed
US-20080200567-A1 IN VIVO SCREENING MODELS FOR TREATMENT OF ALZHEIMER'S DISEASE AND OTHER QPCT-RELATED DISORDERS PROBIODRUG AG (DE) 2008-08-21 US disclosed
WO-2008087197-A1 IN VIVO SCREENING MODELS FOR TREATMENT OF ALZHEIMER'S DISEASE AND OTHER QPCT-RELATED DISORDERS PROBIODRUG AG (DE) 2008-07-24 WO disclosed
US-7285635-B2 Modified proteins, designer toxins, and methods of making thereof RESEARCH DEVELOPMENT FOUNDATION (US) 2007-10-23 US disclosed
US-20070036780-A1 Reducing the antigenicity of a proteinaceous compound while maintaining the compound's biological activity ROSENBLUM MICHAEL G 2007-02-15 US disclosed
US-7083957-B2 Modified proteins, designer toxins, and methods of making thereof REASEARCH DEVELOPMENT FOUNDATION (US) 2006-08-01 US disclosed
EP-1406644-A4 MODIFIED PROTEINS, DESIGNER TOXINS, AND METHODS OF MAKING THEREOF RES DEV FOUNDATION (US) 2005-03-16 EP disclosed
EP-1406644-A2 MODIFIED PROTEINS, DESIGNER TOXINS, AND METHODS OF MAKING THEREOF RESEARCH DEVELOPMENT FOUNDATION (US) 2004-04-14 EP disclosed
US-20030176331-A1 Modified proteins, designer toxins, and methods of making thereof RESEARCH DEVELOPMENT FOUNDATION 2003-09-18 US disclosed
WO-2002069886-A2 MODIFIED PROTEINS, DESIGNER TOXINS, AND METHODS OF MAKING THEREOF RESEARCH DEVELOPMENT FOUNDATION (US) 2002-09-12 WO disclosed
EP-0382990-A1 Strains of bacillus thuringiensis PLANT GENETIC SYSTEMS, N.V. (BE) 1990-08-22 EP 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-20120070444-A1 IN VIVO SCREENING MODELS FOR TREATMENT OF isoQC-RELATED DISORDERS NDUFAF1, UQCRC1, CPT1A MEN1 3680/4885KMT2A 2022/4885MAPT 3663/4885
US-20080200567-A1 IN VIVO SCREENING MODELS FOR TREATMENT OF ALZHEIMER'S DISEASE AND OTHER QPCT-RELATED DISORDERS QPCT, PCYT1A, PSEN2 MEN1 3714/4885KMT2A 1486/4885MAPT 11/4885

“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.