SCHEMBL1899386

SCHEMBL1899386

COC(=O)c1ccc(-n2sccc2=O)cc1

nearest known ligand 0.71

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.71
KAT2B Q92831 5/20 0.53
EP300 Q09472 3/20 0.51
CA1 P00915 2/20 0.49
CA2 P00918 2/20 0.49
TDP1 Q9NUW8 1/20 0.46
CA12 O43570 1/20 0.46
CA7 P43166 1/20 0.46
CA9 Q16790 1/20 0.46
CA14 Q9ULX7 1/20 0.46
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
HTT P42858 2/20 0.44
HPGD P15428 1/20 0.43
TSHR P16473 1/20 0.43
MAPT P10636 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
SCHEMBL28924298 0.76 IDO1 (0.67) IDO1KAT2BEP300TDP1ALDH1A1
SCHEMBL1956520 0.73 KAT2B (0.65) IDO1KAT2BEP300TDP1ALDH1A1
SCHEMBL9189815 0.72 CA1 (0.55) CA1CA2TDP1CA12CA7
SCHEMBL23600 0.72 CA1 (0.80) CA1CA2TDP1CA12CA7
SCHEMBL28993944 0.72 CA1 (0.80) CA1CA2TDP1CA12CA7
SCHEMBL28993277 0.70 CA1 (0.76) CA1CA2TDP1CA12CA7
Methyl Alcohol SCHEMBL28561085 0.70 CA1 (0.76) CA1CA2TDP1CA12CA7
Water SCHEMBL22720573 0.70 CA1 (0.76) CA1CA2TDP1CA12CA7
SCHEMBL28704033 0.70 CA1 (0.76) CA1CA2TDP1CA12CA7
Ammonia Solution, Strong SCHEMBL28873355 0.70 CA1 (0.76) CA1CA2TDP1CA12CA7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210060051-A1 COMBINED MODALITIES FOR NUCLEOSIDES AND/OR NADPH OXIDASE (NOX) INHIBITORS AS MYELOID-SPECIFIC ANTIVIRAL AGENTS EMORY UNIVERSITY 2021-03-04 US claimed
EP-3732180-A1 COMBINED MODALITIES FOR NUCLEOSIDES AND/OR NADPH OXIDASE (NOX) INHIBITORS AS MYELOID-SPECIFIC ANTIVIRAL AGENTS Emory University (US) 2020-11-04 EP claimed
WO-2011062864-A2 INHIBITORS OF NOX ENZYMES AND METHODS OF USE THEREOF EMORY UNIVERSITY (US) 2011-05-26 WO claimed
US-12239655-B2 Combined modalities for nucleosides and/or NADPH oxidase (NOX) inhibitors as myeloid-specific antiviral agents EMORY UNIVERSITY (US) 2025-03-04 US disclosed
US-20210060051-A1 COMBINED MODALITIES FOR NUCLEOSIDES AND/OR NADPH OXIDASE (NOX) INHIBITORS AS MYELOID-SPECIFIC ANTIVIRAL AGENTS EMORY UNIVERSITY 2021-03-04 US disclosed
EP-3732180-A1 COMBINED MODALITIES FOR NUCLEOSIDES AND/OR NADPH OXIDASE (NOX) INHIBITORS AS MYELOID-SPECIFIC ANTIVIRAL AGENTS Emory University (US) 2020-11-04 EP disclosed
WO-2011062864-A2 INHIBITORS OF NOX ENZYMES AND METHODS OF USE THEREOF EMORY UNIVERSITY (US) 2011-05-26 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 (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-20210060051-A1 COMBINED MODALITIES FOR NUCLEOSIDES AND/OR NADPH OXIDASE (NOX) INHIBITORS AS MYELOID-SPECIFIC ANTIVIRAL AGENTS NOX1, NOX3, NOX4 IDO1 284/4885KAT2B 1275/4885EP300 1632/4885
US-12239655-B2 Combined modalities for nucleosides and/or NADPH oxidase (NOX) inhibitors as myeloid-specific antiviral agents NOX1, NOX3, NOX4 IDO1 236/4885KAT2B 1552/4885EP300 1042/4885

“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.