SCHEMBL2438599

SCHEMBL2438599

O=c1c2ccccc2[nH]n1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MPI P34949 1/20 1.00
TRPV1 Q8NER1 1/20 0.67
TSHR P16473 1/20 0.66
ALOX5 P09917 1/20 0.57
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
PDE7A Q13946 1/20 0.51
PDE7B Q9NP56 1/20 0.51
GAA P10253 1/20 0.49
ALOX15 P16050 1/20 0.49
HTT P42858 1/20 0.47

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
SCHEMBL30423726 1.00 MPI (1.00) MPITRPV1TSHRALOX5MEN1
SCHEMBL4142034 0.86 MPI (0.76) MPITRPV1TSHRALOX5MEN1
SCHEMBL9647788 0.85 MPI (0.73) MPITRPV1TSHRALOX5MEN1
SCHEMBL28345280 0.85 MPI (0.73) MPITRPV1TSHRALOX5MEN1
SCHEMBL28345371 0.85 MPI (0.73) MPITRPV1TSHRALOX5MEN1
SCHEMBL29552755 0.85 MPI (0.73) MPITRPV1TSHRALOX5MEN1
SCHEMBL28396372 0.85 MPI (0.73) MPITRPV1TSHRALOX5MEN1
SCHEMBL11279279 0.85 MPI (0.73) MPITRPV1TSHRALOX5MEN1
SCHEMBL9645125 0.81 MPI (0.67) MPITRPV1ALOX5MEN1KMT2A
SCHEMBL9647842 0.81 MPI (0.67) MPITRPV1TSHRALOX5MEN1

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
CN-110655521-A 12H-indazole [2,1-a ] cinnoline-12-ketone compound and application thereof 浙江工业大学 2020-01-07 CN claimed
CN-110742892-B Application of 12H-indazole [2,1-a ] cinnoline-12-ketone compound 浙江工业大学 2022-05-24 CN disclosed
CN-110655521-B 12H-indazole [2,1-a ] cinnoline-12-ketone compound and application thereof 浙江工业大学 2020-10-27 CN disclosed
CN-110742892-A Application of 12H-indazole [2,1-a ] cinnoline-12-ketone compound 浙江工业大学 2020-02-04 CN disclosed
CN-110655521-A 12H-indazole [2,1-a ] cinnoline-12-ketone compound and application thereof 浙江工业大学 2020-01-07 CN disclosed
US-20170095485-A1 METHODS AND COMPOUNDS TO INHIBIT ENVELOPED VIRUS RELEASE The Research Foundation for the State of University of New York 2017-04-06 US disclosed
US-20170095485-A1 METHODS AND COMPOUNDS TO INHIBIT ENVELOPED VIRUS RELEASE The Research Foundation for the State of University of New York 2017-04-06 US disclosed
US-20140179637-A1 METHODS AND COMPOUNDS TO INHIBIT ENVELOPED VIRUS RELEASE THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2014-06-26 US disclosed
US-20140179637-A1 METHODS AND COMPOUNDS TO INHIBIT ENVELOPED VIRUS RELEASE THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2014-06-26 US disclosed
US-20110257233-A1 BENZOISOTHIAZOLONES AS INHIBITORS OF PHOSPHOMANNOSE ISOMERASE SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-10-20 US disclosed
WO-2011116355-A2 BENZOISOTHIAZOLONES AS INHIBITORS OF PHOSPHOMANNOSE ISOMERASE SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2011-09-22 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 (3 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-20170095485-A1 METHODS AND COMPOUNDS TO INHIBIT ENVELOPED VIRUS RELEASE SARS1, EEA1, ZC3HAV1 MPI 840/4885TRPV1 3204/4885TSHR 4452/4885
US-20140179637-A1 METHODS AND COMPOUNDS TO INHIBIT ENVELOPED VIRUS RELEASE SARS1, EEA1, ZC3HAV1 MPI 840/4885TRPV1 3204/4885TSHR 4452/4885
US-20110257233-A1 BENZOISOTHIAZOLONES AS INHIBITORS OF PHOSPHOMANNOSE ISOMERASE MPI, PMM2, GPI MPI 1/4885TRPV1 4837/4885TSHR 4298/4885

“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.