SCHEMBL16972799

SCHEMBL16972799

CCn1cnc2ccc([N+](=O)[O-])cc2c1=O

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.68
MAPT P10636 10/20 0.53
MAPK1 P28482 4/20 0.52
ALDH1A1 P00352 4/20 0.52
HTT P42858 4/20 0.52
POLB P06746 2/20 0.52
KMT2A Q03164 6/20 0.51
MEN1 O00255 5/20 0.51
GAA P10253 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
LMNA P02545 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
PARP1 P09874 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
SCHEMBL30656820 1.00 L3MBTL1 (0.68) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL26758109 0.87 L3MBTL1 (0.66) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL30656841 0.84 L3MBTL1 (0.66) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL26758084 0.84 L3MBTL1 (0.62) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL26758089 0.83 L3MBTL1 (0.64) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL26758098 0.83 L3MBTL1 (0.64) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL26758160 0.83 MAPT (0.64) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL28590279 0.83 L3MBTL1 (0.60) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL30656819 0.82 MAPT (0.57) L3MBTL1MAPTMAPK1ALDH1A1HTT
SCHEMBL26758086 0.82 MAPT (0.57) L3MBTL1MAPTMAPK1ALDH1A1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357165-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2023-11-09 US disclosed
US-20230357165-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2023-11-09 US disclosed
EP-4171569-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF Council of Scientific & Industrial Research (IN) 2023-05-03 EP disclosed
WO-2022003712-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) 2022-01-06 WO disclosed
US-20180289718-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2018-10-11 US disclosed
US-10016439-B2 Fused imidazole compounds ONO PHARMACEUTICAL CO., LTD. (JP) 2018-07-10 US disclosed
EP-3099672-A1 FUSED IMIDAZOLE COMPOUNDS ONO Pharmaceutical Co., Ltd. (JP) 2016-12-07 EP disclosed
US-20160331757-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2016-11-17 US disclosed
WO-2015115673-A1 FUSED IMIDAZOLE COMPOUNDS ONO PHARMACEUTICAL CO., LTD. (JP) 2015-08-06 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-20230357165-A1 QUINAZOLINONES DERIVATIVES FOR TREATMENT OF NON-ALCOHOLIC FATTY LIVER DISEASE, PREPARATION AND USE THEREOF ATG7, GOT1, LIPC L3MBTL1 1585/4885MAPT 2243/4885MAPK1 2282/4885
US-20180289718-A1 FUSED IMIDAZOLE COMPOUNDS GABRA5, CHRNA5, GABRP L3MBTL1 4464/4885MAPT 106/4885MAPK1 3234/4885
US-20160331757-A1 FUSED IMIDAZOLE COMPOUNDS GABRA5, CHRNA5, GABRP L3MBTL1 4464/4885MAPT 106/4885MAPK1 3234/4885
US-10016439-B2 Fused imidazole compounds GABRA5, CHRNA5, GABRP L3MBTL1 4464/4885MAPT 106/4885MAPK1 3234/4885

“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.