SCHEMBL1781383

SCHEMBL1781383

CN(C)C(=O)c1ccc([N+](=O)[O-])cc1F

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.65
KMT2A Q03164 4/20 0.50
HPGD P15428 2/20 0.50
MEN1 O00255 2/20 0.50
NPSR1 Q6W5P4 1/20 0.50
ALDH1A1 P00352 7/20 0.49
HTT P42858 2/20 0.49
HIF1A Q16665 1/20 0.46
CYP3A4 P08684 1/20 0.45
ALOX15 P16050 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
HKDC1 Q2TB90 1/20 0.45
GAA P10253 1/20 0.44
MAPT P10636 3/20 0.43
THRB P10828 1/20 0.43
KDM4E B2RXH2 1/20 0.43
POLB P06746 1/20 0.43
TP53 P04637 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 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
SCHEMBL16115685 0.88 L3MBTL1 (0.50) L3MBTL1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL5913520 0.87 L3MBTL1 (0.69) L3MBTL1KMT2AHPGDMEN1NPSR1
SCHEMBL3012179 0.85 L3MBTL1 (0.48) L3MBTL1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL17512318 0.83 ALDH1A1 (0.46) L3MBTL1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL17512317 0.83 ALDH1A1 (0.46) L3MBTL1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL20401009 0.82 L3MBTL1 (0.77) L3MBTL1KMT2AHPGDMEN1NPSR1
SCHEMBL2569392 0.82 L3MBTL1 (0.67) L3MBTL1KMT2AHPGDMEN1NPSR1
SCHEMBL31509357 0.81 MAPT (0.56) L3MBTL1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL1360146 0.81 MAPT (0.56) L3MBTL1KMT2AMEN1NPSR1ALDH1A1
SCHEMBL3190849 0.81 L3MBTL1 (0.65) L3MBTL1KMT2AHPGDMEN1NPSR1

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-2792674-B1 IMIDAZOLIDINEDIONE COMPOUNDS AND THEIR USES HINOVA PHARMACEUTICAL INC (CN) 2016-05-25 EP disclosed
US-9346764-B2 Imidazolidinedione compounds and their uses HINOVA PHARMACEUTICALS INC. (CN) 2016-05-24 US disclosed
US-9346764-B2 Imidazolidinedione compounds and their uses HINOVA PHARMACEUTICALS INC. (CN) 2016-05-24 US disclosed
US-9346764-B2 Imidazolidinedione compounds and their uses HINOVA PHARMACEUTICALS INC. (CN) 2016-05-24 US disclosed
US-9115092-B2 Substituted quinazoline and pyrido-pyrimidine derivatives ASANA BIOSCIENCES, LLC (US) 2015-08-25 US disclosed
US-9115092-B2 Substituted quinazoline and pyrido-pyrimidine derivatives ASANA BIOSCIENCES, LLC (US) 2015-08-25 US disclosed
US-9115092-B2 Substituted quinazoline and pyrido-pyrimidine derivatives ASANA BIOSCIENCES, LLC (US) 2015-08-25 US disclosed
US-20150011547-A1 SUBSTITUTED QUINAZOLINE AND PYRIDO-PYRIMIDINE DERIVATIVES ASANA BIOSCIENCES, LLC (US) 2015-01-08 US disclosed
US-20150011547-A1 SUBSTITUTED QUINAZOLINE AND PYRIDO-PYRIMIDINE DERIVATIVES ASANA BIOSCIENCES, LLC (US) 2015-01-08 US disclosed
US-20150011547-A1 SUBSTITUTED QUINAZOLINE AND PYRIDO-PYRIMIDINE DERIVATIVES ASANA BIOSCIENCES, LLC (US) 2015-01-08 US disclosed
US-20120129851-A1 Substituted Quinazoline and Pyrido-Pyrimidine Derivatives ENDO PHARMACEUTICALS INC. (US) 2012-05-24 US disclosed
US-20120108567-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 US disclosed
US-20120108567-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 US disclosed
US-20120108567-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-03 US disclosed
WO-2012058671-A1 SUBSTITUTED QUINAZOLINE AND PYRIDO-PYRIMIDINE DERIVATIVES ENDO PHARMACEUTICALS INC. (US) 2012-05-03 WO disclosed
WO-2012058671-A1 SUBSTITUTED QUINAZOLINE AND PYRIDO-PYRIMIDINE DERIVATIVES ENDO PHARMACEUTICALS INC. (US) 2012-05-03 WO disclosed
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-19 US disclosed
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-19 US disclosed
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-05-19 US disclosed
WO-2009112565-A1 THIAZOLYL-DIHYDRO-INDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-09-17 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-20120108567-A1 Thiazolyl-Dihydro-Indazoles MKI67, CYP11B1, IGF1R L3MBTL1 777/4885KMT2A 2863/4885HPGD 998/4885
US-20110118208-A1 Thiazolyl-Dihydro-Indazoles MKI67, CYP11B1, IGF1R L3MBTL1 777/4885KMT2A 2863/4885HPGD 998/4885
US-20150011547-A1 SUBSTITUTED QUINAZOLINE AND PYRIDO-PYRIMIDINE DERIVATIVES MTOR, PIK3CA, PDPK1 L3MBTL1 3261/4885KMT2A 1584/4885HPGD 1434/4885
US-20120129851-A1 Substituted Quinazoline and Pyrido-Pyrimidine Derivatives MTOR, PIK3CA, PDPK1 L3MBTL1 3261/4885KMT2A 1584/4885HPGD 1434/4885

“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.