SCHEMBL14680241

SCHEMBL14680241

O=C(NN1C(=O)/C(=C\C=C\c2ccco2)SC1=S)c1ccccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 16/20 1.00
▸ KMT2A Q03164 16/20 1.00
▸ MAPT P10636 14/20 1.00
▸ L3MBTL1 Q9Y468 11/20 1.00
▸ POLB P06746 10/20 1.00
▸ KDM4E B2RXH2 9/20 1.00
▸ RECQL P46063 9/20 1.00
▸ BLM P54132 7/20 1.00
▸ TDP1 Q9NUW8 7/20 1.00
▸ MCL1 Q07820 5/20 1.00
▸ THRB P10828 5/20 1.00
▸ ALPL P05186 4/20 1.00
▸ ALPI P09923 2/20 1.00
▸ ALPG P10696 2/20 1.00
▸ PKM P14618 1/20 1.00
▸ USP2 O75604 9/20 0.70
▸ APEX1 P27695 6/20 0.70
▸ GAA P10253 3/20 0.70
▸ ATG4B Q9Y4P1 2/20 0.70
▸ SAE1 Q9UBE0 2/20 0.70

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
SCHEMBL17229211 0.90 KMT2A (0.82) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL17229213 0.80 MAPT (0.67) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL29354790 0.77 MAPT (1.00) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL14680208 0.77 MAPT (1.00) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL19419943 0.77 MAPT (0.62) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL3969214 0.74 MEN1 (0.69) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL3969218 0.74 MEN1 (0.69) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL6720203 0.73 MEN1 (0.85) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL26485785 0.73 MAPT (0.65) MEN1KMT2AMAPTL3MBTL1POLB
SCHEMBL15347090 0.72 MEN1 (0.79) MEN1KMT2AMAPTL3MBTL1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230364057-A1 BACTERIAL DNA GYRASE INHIBITORS AND METHODS OF USE THEREOF UNIVERSITY OF CENTRAL FLORIDA RESEARCH FOUNDATION, INC. 2023-11-16 — — US disclosed
US-20230136466-A1 BACTERIAL DNA GYRASE INHIBITORS AND METHODS OF USE THEREOF THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2023-05-04 — — US disclosed
US-20230136466-A1 BACTERIAL DNA GYRASE INHIBITORS AND METHODS OF USE THEREOF THE FLORIDA INTERNATIONAL UNIVERSITY BOARD OF TRUSTEES (US) 2023-05-04 — — US disclosed
US-20130035304-A1 SMALL MOLECULES FOR THE MODULATION OF MCL-1 AND METHODS OF MODULATING CELL DEATH, CELL DIVISION, CELL DIFFERENTIATION AND METHODS OF TREATING DISORDERS NATIONAL INSTITUTES OF HEALTH-DIRECTOR DEITR 2013-02-07 — — 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 (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-20130035304-A1 SMALL MOLECULES FOR THE MODULATION OF MCL-1 AND METHODS OF MODULATING CELL DEATH, CELL DIVISION, CELL DIFFERENTIATION AND METHODS OF TREATING DISORDERS MCL1, BCL2, BCL2L1 MEN1 3272/4885KMT2A 2775/4885MAPT 3689/4885
US-20230364057-A1 BACTERIAL DNA GYRASE INHIBITORS AND METHODS OF USE THEREOF TOP1, DNA2, TOP2A MEN1 4457/4885KMT2A 2037/4885MAPT 3260/4885
US-20230136466-A1 BACTERIAL DNA GYRASE INHIBITORS AND METHODS OF USE THEREOF TOP1, DNA2, TOP2A MEN1 4457/4885KMT2A 2037/4885MAPT 3260/4885

“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.

Send feedback