SCHEMBL679125

SCHEMBL679125

CCOC(=O)CC(=O)Nc1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.69
ALDH1A1 P00352 4/20 0.56
L3MBTL1 Q9Y468 1/20 0.55
MAPT P10636 4/20 0.54
GAA P10253 3/20 0.54
MAPK1 P28482 1/20 0.54
SMN1; SMN2 Q16637 2/20 0.53
PKM P14618 1/20 0.53
HSD17B10 Q99714 1/20 0.52
HPGD P15428 1/20 0.51
MAOB P27338 1/20 0.51

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
Hydrochloric Acid SCHEMBL7130171 0.98 TSHR (0.67) TSHRALDH1A1L3MBTL1MAPTGAA
SCHEMBL70342 0.90 TSHR (0.66) TSHRALDH1A1L3MBTL1MAPTGAA
SCHEMBL5592685 0.86 MAPT (0.63) ALDH1A1L3MBTL1MAPTGAASMN1; SMN2
SCHEMBL8142603 0.86 TSHR (0.73) TSHRALDH1A1MAPTGAAPKM
SCHEMBL7821728 0.85 TSHR (0.77) TSHRALDH1A1L3MBTL1MAPTGAA
SCHEMBL22363340 0.84 TSHR (0.51) TSHRALDH1A1L3MBTL1MAPTGAA
SCHEMBL3067050 0.83 HPGD (0.66) ALDH1A1MAPTSMN1; SMN2HPGD
SCHEMBL28855893 0.83 ALDH1A1 (0.70) ALDH1A1HPGD
SCHEMBL26998806 0.83 HPGD (0.59) TSHRALDH1A1L3MBTL1MAPK1HSD17B10
SCHEMBL307601 0.83 MAPT (0.59) ALDH1A1L3MBTL1MAPTGAAMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116693531-A Synthesis method of bridged polycyclic lactam compound 河南师范大学 2023-09-05 CN claimed
EP-3762392-B1 THIENOPYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME WELLMARKER BIO CO LTD (KR) 2024-05-15 EP disclosed
US-11932640-B1 Pyrrolo[3,4-b]quinoline compounds as antibacterial agents King Faisal University (SA) 2024-03-19 US disclosed
US-11807639-B1 Pyrrolo[3,4-b]quinoline compounds as antibacterial agents King Faisal University (SA) 2023-11-07 US disclosed
US-11807639-B1 Pyrrolo[3,4-b]quinoline compounds as antibacterial agents King Faisal University (SA) 2023-11-07 US disclosed
CN-116693531-A Synthesis method of bridged polycyclic lactam compound 河南师范大学 2023-09-05 CN disclosed
US-11447500-B2 Thienopyridine derivatives and pharmaceutical composition comprising same WELLMARKER BIO CO., LTD. (KR) 2022-09-20 US disclosed
US-20220288043-A1 THIENOPYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME WELLMARKER BIO CO, LTD. (KR) 2022-09-15 US disclosed
CN-111295386-B Thienopyridine derivatives and pharmaceutical compositions containing the same 伟迈可生物有限公司 2022-09-06 CN disclosed
CN-113121435-B Synthetic method of 2, 4-dichloroquinoline compound 辽宁大学 2022-08-30 CN disclosed
EP-1982978-A1 PYRIDONE DERIVATIVE AND HERBICIDE KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) 2008-10-22 EP disclosed
EP-0449346-B1 4-Piperidinyl-ergoline derivatives PHARMACIA SPA (IT) 1995-05-10 EP disclosed
US-5382590-A Gastrointestinal disorders and nervous system disorders RHONE-POULENC RORER S.A. (FR) 1995-01-17 US disclosed
EP-0449346-A2 4-Piperidinyl-ergoline derivatives PHARMACIA S.p.A. (IT) 1991-10-02 EP disclosed
US-4738971-A ENHANCED CELL-MEDIATED IMMUNITY; ANTIARTHRITIC AGENTS; NONTOXIC AKTIEBOLASET LEO (SE) 1988-04-19 US disclosed
US-4736056-A Process for the production of malonic acid derivative compounds UNION CARBIDE AGRICULTURAL PRODUCTS COMPANY, INC., T.W. ALEXANDER DR., RESEARCH TRIANGLE PARK, NC. A CORP. OF PA. 1988-04-05 US disclosed
US-4547511-A FOR ENHANCIN CELL-MEDIATED IMMUNITY AKTIEBOLAGET LEO (SE) 1985-10-15 US disclosed
EP-0059698-B1 HETEROCYCLIC CARBOXAMIDES, COMPOSITIONS CONTAINING SUCH COMPOUNDS, PROCESSES FOR THEIR PREPARATION AND METHODS OF TREATMENT THEREWITH AB LEO (SE) 1985-09-25 EP disclosed
US-4407797-A ANTIULCER AGENT RHONE-POULENC SANTE (FR) 1983-10-04 US disclosed
EP-0059698-A1 Heterocyclic carboxamides, compositions containing such compounds, processes for their preparation and methods of treatment therewith AB LEO (SE) 1982-09-08 EP 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-11447500-B2 Thienopyridine derivatives and pharmaceutical composition comprising same MAP4K5, MAP4K2, MAP3K9 TSHR 1782/4885ALDH1A1 2254/4885L3MBTL1 4523/4885
US-11932640-B1 Pyrrolo[3,4-b]quinoline compounds as antibacterial agents POLB, POLA1, POLR2B TSHR 4253/4885ALDH1A1 2997/4885L3MBTL1 3525/4885
US-11807639-B1 Pyrrolo[3,4-b]quinoline compounds as antibacterial agents POLB, TOP2A, POLI TSHR 4059/4885ALDH1A1 3656/4885L3MBTL1 3460/4885
US-20220288043-A1 THIENOPYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME PRKACA, MAP4K5, MAPKAPK5 TSHR 2315/4885ALDH1A1 2359/4885L3MBTL1 4397/4885

“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.