SCHEMBL20042977

SCHEMBL20042977

CN(C)CCCN1C(=O)c2cccc3c(Br)ccc(c23)C1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 1.00
ALDH1A1 P00352 3/20 1.00
MEN1 O00255 2/20 1.00
LMNA P02545 2/20 1.00
PABPC1 P11940 2/20 1.00
KMT2A Q03164 2/20 1.00
KDM4E B2RXH2 1/20 1.00
NPC1 O15118 1/20 1.00
MAPT P10636 1/20 1.00
TERT O14746 2/20 0.67
NR1I2 O75469 1/20 0.67
AHR P35869 1/20 0.67
RAD52 P43351 1/20 0.67
RCE1 Q9Y256 1/20 0.67
CCR6 P51684 1/20 0.67
SMN1; SMN2 Q16637 1/20 0.67
NPSR1 Q6W5P4 1/20 0.67
CYP1B1 Q16678 11/20 0.65
STAT3 P40763 1/20 0.64
HIF1A Q16665 1/20 0.64

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
SCHEMBL12133952 0.92 POLB (0.85) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL30499259 0.85 POLB (0.74) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL3773566 0.85 POLB (0.74) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL22717100 0.84 MEN1 (0.73) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL22716950 0.84 POLB (0.73) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL16224764 0.84 KMT2A (0.73) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL21988152 0.84 POLB (0.72) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL23295238 0.83 POLB (0.70) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL21988116 0.83 POLB (0.70) POLBALDH1A1MEN1LMNAPABPC1
SCHEMBL23295234 0.83 POLB (0.70) POLBALDH1A1MEN1LMNAPABPC1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117626650-A Multi-mode light-driven antibacterial fabric based on functional intermolecular assembly induction and preparation method thereof 浙江理工大学 2024-03-01 CN claimed
CN-114276295-B Guided tissue regeneration membrane containing TPE-NIM fluorescent probe and preparation method thereof 南京医科大学附属口腔医院 2023-12-05 CN claimed
US-11717508-B2 Compounds, compositions, and methods for inhibiting bacterial growth BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-08-08 US claimed
CN-114276295-A Guided tissue regeneration membrane containing TPE-NIM fluorescent probe and preparation method thereof 南京医科大学附属口腔医院 2022-04-05 CN claimed
CN-117626650-A Multi-mode light-driven antibacterial fabric based on functional intermolecular assembly induction and preparation method thereof 浙江理工大学 2024-03-01 CN disclosed
CN-114276295-B Guided tissue regeneration membrane containing TPE-NIM fluorescent probe and preparation method thereof 南京医科大学附属口腔医院 2023-12-05 CN disclosed
CN-114276295-B Guided tissue regeneration membrane containing TPE-NIM fluorescent probe and preparation method thereof 南京医科大学附属口腔医院 2023-12-05 CN disclosed
US-11717508-B2 Compounds, compositions, and methods for inhibiting bacterial growth BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-08-08 US disclosed
US-11717508-B2 Compounds, compositions, and methods for inhibiting bacterial growth BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-08-08 US disclosed
US-11717508-B2 Compounds, compositions, and methods for inhibiting bacterial growth BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-08-08 US disclosed
US-11617740-B2 Chemical inhibitors of Mycobacterium tuberculosis DosRST signaling and persistence BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2023-04-04 US disclosed
US-20220227648-A1 METHOD OF CONTROLLING CARBONATE SCALE IN AQUEOUS SYSTEMS NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2022-07-21 US disclosed
CN-112867920-A Method for controlling scale in water systems 诺力昂化学品国际有限公司 2021-05-28 CN disclosed
US-20210000799-A1 CHEMICAL INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS DOSRST SIGNALING AND PERSISTENCE BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2021-01-07 US disclosed
WO-2020243180-A1 METHOD OF CONTROLLING CARBONATE SCALE IN AQUEOUS SYSTEMS NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2020-12-03 WO disclosed
WO-2020243176-A1 METHOD OF CONTROLLING SCALE IN AQUEOUS SYSTEMS NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2020-12-03 WO disclosed
WO-2020243176-A1 METHOD OF CONTROLLING SCALE IN AQUEOUS SYSTEMS NOURYON CHEMICALS INTERNATIONAL B.V. (NL) 2020-12-03 WO disclosed
US-20200046678-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INHIBITING BACTERIAL GROWTH BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2020-02-13 US disclosed
US-20200046678-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INHIBITING BACTERIAL GROWTH BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY 2020-02-13 US disclosed
WO-2018067769-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INHIBITING BACTERIAL GROWTH BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2018-04-12 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-11617740-B2 Chemical inhibitors of Mycobacterium tuberculosis DosRST signaling and persistence DLAT, FNTB, DNTT POLB 900/4885ALDH1A1 2276/4885MEN1 3744/4885
US-20210000799-A1 CHEMICAL INHIBITORS OF MYCOBACTERIUM TUBERCULOSIS DOSRST SIGNALING AND PERSISTENCE DLAT, FNTB, DNTT POLB 900/4885ALDH1A1 2276/4885MEN1 3744/4885
US-11717508-B2 Compounds, compositions, and methods for inhibiting bacterial growth LSS, PGLS, GLA POLB 143/4885ALDH1A1 2471/4885MEN1 2809/4885
US-20200046678-A1 COMPOUNDS, COMPOSITIONS, AND METHODS FOR INHIBITING BACTERIAL GROWTH LSS, PGLS, GLA POLB 143/4885ALDH1A1 2471/4885MEN1 2809/4885

“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.