SCHEMBL16291336

SCHEMBL16291336

NC(=O)c1ccc2c(c1)NC(=O)c1ccccc1S2

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.66
TP53 P04637 6/20 0.63
MAPT P10636 4/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
RXFP1 Q9HBX9 2/20 0.63
L3MBTL1 Q9Y468 2/20 0.62
POLB P06746 2/20 0.60
THRB P10828 1/20 0.60
BLM P54132 1/20 0.60
TDP1 Q9NUW8 1/20 0.60
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
GAA P10253 2/20 0.54
ALOX15 P16050 2/20 0.54
CYBB P04839 1/20 0.54
APP P05067 1/20 0.54
SNCA P37840 1/20 0.54
NOX3 Q9HBY0 1/20 0.54
NOX4 Q9NPH5 1/20 0.54
NOX1 Q9Y5S8 1/20 0.54

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
SCHEMBL11398160 0.90 L3MBTL1 (0.60) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL4670438 0.89 HPGD (0.70) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL11396667 0.87 L3MBTL1 (0.60) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL4670606 0.84 TP53 (0.78) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL29355925 0.84 TP53 (0.78) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL29441686 0.83 HPGD (0.51) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL17085845 0.83 HPGD (0.51) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL3580166 0.83 NOX1 (0.74) TP53MAPTSMN1; SMN2L3MBTL1POLB
SCHEMBL17086078 0.82 TP53 (0.83) HPGDTP53MAPTSMN1; SMN2RXFP1
SCHEMBL18664561 0.81 HPGD (0.58) HPGDTP53MAPTSMN1; SMN2RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230019129-A1 HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2023-01-19 US disclosed
US-10947224-B2 Hepatitis B core protein allosteric modulators INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2021-03-16 US disclosed
US-10633369-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2020-04-28 US disclosed
US-10183936-B2 Hepatitis B core protein allosteric modulators INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2019-01-22 US disclosed
US-20180201606-A1 METHOD OF INHIBITING DYRK1B 4 SC AG (DE) 2018-07-19 US disclosed
US-9951050-B2 Method of inhibiting DYRK1B 4 SC AG (DE) 2018-04-24 US disclosed
US-20170015658-A1 HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2017-01-19 US disclosed
US-20170015658-A1 HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION 2017-01-19 US disclosed
WO-2015138895-A1 HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS INDIANA UNIVERSITY RESEARCH AND TECHNOLOGY CORPORATION (US) 2015-09-17 WO disclosed
US-20140371251-A1 METHOD OF INHIBITING DYRK1B 4SC DISCOVERY GMBH (DE) 2014-12-18 US 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 (7 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-20170015658-A1 HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS HAVCR2, MAVS, FABP1 HPGD 3691/4885TP53 602/4885MAPT 2680/4885
US-10633369-B2 Method of inhibiting DYRK1B SMO, GLI1, GRK2 HPGD 2938/4885TP53 1731/4885MAPT 4239/4885
US-20230019129-A1 HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS HAVCR2, MAVS, FABP1 HPGD 3691/4885TP53 602/4885MAPT 2680/4885
US-10183936-B2 Hepatitis B core protein allosteric modulators HAVCR2, MAVS, FABP1 HPGD 3691/4885TP53 602/4885MAPT 2680/4885
US-20180201606-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 HPGD 2938/4885TP53 1731/4885MAPT 4239/4885
US-20140371251-A1 METHOD OF INHIBITING DYRK1B SMO, GLI1, GRK2 HPGD 2938/4885TP53 1731/4885MAPT 4239/4885
US-10947224-B2 Hepatitis B core protein allosteric modulators HAVCR2, MAVS, FABP1 HPGD 3691/4885TP53 602/4885MAPT 2680/4885

“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.