SCHEMBL3669346

SCHEMBL3669346

O=C(Nc1ccc(CNc2ccccc2[N+](=O)[O-])cc1)c1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.60
L3MBTL1 Q9Y468 2/20 0.60
NPC1 O15118 3/20 0.57
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
POLB P06746 2/20 0.57
RAB9A P51151 2/20 0.57
MITF O75030 1/20 0.57
RECQL P46063 1/20 0.54
PHGDH O43175 1/20 0.52
HDAC1 Q13547 2/20 0.52
ABCG2 Q9UNQ0 1/20 0.52
LMNA P02545 2/20 0.51
ALDH1A1 P00352 1/20 0.51
GAA P10253 1/20 0.51
SLC12A2 P55011 1/20 0.51
SLC12A5 Q9H2X9 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.50
MAPK1 P28482 1/20 0.50
SERPINE1 P05121 1/20 0.49

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
SCHEMBL3665346 0.87 KMT2A (0.61) MAPTL3MBTL1NPC1MEN1KMT2A
SCHEMBL1843232 0.83 MAPT (0.68) MAPTL3MBTL1MEN1KMT2APOLB
SCHEMBL7164868 0.82 MAPT (0.84) MAPTL3MBTL1NPC1MEN1KMT2A
SCHEMBL102602 0.81 MAPT (0.77) MAPTL3MBTL1NPC1MEN1KMT2A
SCHEMBL1841977 0.80 APP (0.58) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL641989 0.79 PHGDH (0.77) MAPTL3MBTL1NPC1MEN1KMT2A
N-Phenylbenzamide SCHEMBL28793783 0.79 MEN1 (0.71) MAPTL3MBTL1NPC1MEN1KMT2A
SCHEMBL1844781 0.78 APP (0.61) MAPTNPC1MEN1KMT2ARAB9A
SCHEMBL10055047 0.78 MAPT (0.73) MAPTL3MBTL1NPC1MEN1KMT2A
SCHEMBL9689325 0.77 MAPT (0.63) MAPTL3MBTL1NPC1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8436031-B2 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2013-05-07 US disclosed
US-20110306611-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2011-12-15 US disclosed
US-20110306611-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2011-12-15 US disclosed
US-20110306611-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2011-12-15 US disclosed
EP-2139474-A2 TRANSCRIPTION FACTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF Paratek Pharmaceuticals, Inc. (US) 2010-01-06 EP disclosed
US-20090170812-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. (US) 2009-07-02 US disclosed
US-20090131481-A1 Transcription Factor Modulating Compounds and Methods of Use Thereof PARATEK PHARMACEUTICALS, INC. (US) 2009-05-21 US disclosed
WO-2009005551-A2 TRANSCRIPTION FACTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF PARATEK PHARMACEUTICALS, INC. (US) 2009-01-08 WO disclosed
EP-1742637-A2 TRANSCRIPTION FACTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF Paratek Pharmaceuticals, Inc. (US) 2007-01-17 EP disclosed
US-20060160799-A1 Transcription factor modulating compounds and methods of use thereof PARATEK PHARMACEUTICALS, INC. 2006-07-20 US disclosed
WO-2006076009-A2 TRANSCRIPTION FACTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF PARATEK PHARMACEUTICALS, INC. (US) 2006-07-20 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 (4 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-20110306611-A1 Transcription factor modulating compounds and methods of use thereof JUN, CREBBP, TFEB MAPT 4415/4885L3MBTL1 573/4885NPC1 3055/4885
US-20060160799-A1 Transcription factor modulating compounds and methods of use thereof JUN, CREBBP, TFEB MAPT 4415/4885L3MBTL1 573/4885NPC1 3055/4885
US-20090131481-A1 Transcription Factor Modulating Compounds and Methods of Use Thereof CREBBP, JUN, IRF3 MAPT 4703/4885L3MBTL1 244/4885NPC1 3138/4885
US-20090170812-A1 Transcription factor modulating compounds and methods of use thereof JUN, CREBBP, TFEB MAPT 4415/4885L3MBTL1 573/4885NPC1 3055/4885

“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.