SCHEMBL1443579

SCHEMBL1443579

O=Cc1cccc(N2CCCC2)c1

nearest known ligand 0.60

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRIM24 O15164 1/20 0.60
TRIM33 Q9UPN9 1/20 0.60
ALDH1A1 P00352 10/20 0.58
KDM4E B2RXH2 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
ALDH1A3 P47895 5/20 0.51
MEN1 O00255 1/20 0.51
GAA P10253 1/20 0.51
HPGD P15428 1/20 0.51
KMT2A Q03164 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MAPT P10636 1/20 0.45
AGXT P21549 1/20 0.45
HTR7 P34969 1/20 0.45
FGFR1 P11362 1/20 0.44
PRMT6 Q96LA8 1/20 0.44
APP P05067 1/20 0.43

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
SCHEMBL29377692 1.00 TRIM24 (0.60) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL30770827 0.98 ALDH1A1 (0.61) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL1418736 0.98 ALDH1A1 (0.61) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL27906847 0.85 ADRB1 (0.55) TRIM24TRIM33ALDH1A1MAPTHTR7
SCHEMBL13345896 0.84 HTR7 (0.62) ALDH1A1MAPTHTR7
SCHEMBL29442412 0.84 ALDH1A1 (0.64) ALDH1A1KDM4EGAAMAPTAGXT
SCHEMBL31247769 0.84 ALDH3A1 (0.55) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL1444185 0.84 ALDH1A1 (0.64) ALDH1A1KDM4EGAAMAPTAGXT
SCHEMBL1443605 0.84 ALDH3A1 (0.55) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2
SCHEMBL21558444 0.81 TRIM24 (0.61) TRIM24TRIM33ALDH1A1KDM4ESMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013049164-A1 SUBSTITUTED OCTAHYDROPYRROLO[1,2-a]PYRAZINES AS CALCIUM CHANNEL BLOCKERS ABBVIE INC. (US) 2013-04-04 WO claimed
CN-114025847-B Compounds and compositions as modulators of TLR signaling 神经孔疗法股份有限公司 2024-05-24 CN disclosed
US-20230303512-A1 MODULATORS OF MYB-MEDIATED TRANSCRIPTION AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-09-28 US disclosed
US-20230303512-A1 MODULATORS OF MYB-MEDIATED TRANSCRIPTION AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-09-28 US disclosed
US-20230303512-A1 MODULATORS OF MYB-MEDIATED TRANSCRIPTION AND USES THEREOF MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2023-09-28 US disclosed
US-20220396583-A1 COMPOUNDS AS MODULATORS OF TLR2 SIGNALING NEUROPORE THERAPIES, INC. (US) 2022-12-15 US disclosed
EP-3774736-B1 COMPOUNDS AS MODULATORS OF TLR2 SIGNALING NEUROPORE THERAPIES INC (US) 2022-11-16 EP disclosed
US-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING NEUROPORE THERAPIES, INC. (US) 2022-09-22 US disclosed
CN-111592522-B Arginine methylation transferase 5 small-molecule inhibitor and preparation method and application thereof 郑州大学 2022-09-09 CN disclosed
CN-109563043-B Substituted pyridines as inhibitors of DNMT1 葛兰素史密斯克莱知识产权发展有限公司 2022-05-31 CN disclosed
US-20130237525-A1 LACTAM DERIVATIVES USEFUL AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD. (CH) 2013-09-12 US disclosed
US-8486940-B2 Inhibitors PROBIODRUG AG (DE) 2013-07-16 US disclosed
CN-102695546-A Heterocylcic derivatives as inhibitors of glutaminyl cyclase PROBIODRUG AG 2012-09-26 CN disclosed
EP-2475428-A1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE Probiodrug AG (DE) 2012-07-18 EP disclosed
WO-2012063207-A1 LACTAM DERIVATIVES USEFUL AS OREXIN RECEPTOR ANTAGONISTS ACTELION PHARMACEUTICALS LTD (CH) 2012-05-18 WO disclosed
WO-2011094890-A1 PHENYLALANINE DERIVATIVES AND THEIR USE AS NON-PEPTIDE GLP-1 RECEPTOR MODULATORS ARGUSINA INC. (US) 2011-08-11 WO disclosed
US-20110092501-A1 NOVEL INHIBITORS PROBIODRUG AG (DE) 2011-04-21 US disclosed
WO-2011029920-A1 HETEROCYLCIC DERIVATIVES AS INHIBITORS OF GLUTAMINYL CYCLASE PROBIODRUG AG (DE) 2011-03-17 WO disclosed
WO-2009155362-A1 SMALL MOLECULE HEMATOPOIETIC GROWTH FACTOR MIMETIC COMPOUNDS AND THEIR USES LIGAND PHARMACEUTICALS INC. (US) 2009-12-23 WO disclosed
WO-2009038411-A2 BETA-SECRETASE INHIBITING COMPOUNDS HAVING OXO-DIHYDRO-PYRAZOLE MOIETY LG LIFE SCIENCES, LTD. (KR) 2009-03-26 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 (5 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-20220298155-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF TLR SIGNALING TLR3, TLR6, TLR4 TRIM24 1262/4885TRIM33 2157/4885ALDH1A1 4634/4885
US-20130237525-A1 LACTAM DERIVATIVES USEFUL AS OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, NPY1R TRIM24 4272/4885TRIM33 3705/4885ALDH1A1 2282/4885
US-20110092501-A1 NOVEL INHIBITORS GLUL, QPCT, GLS TRIM24 1671/4885TRIM33 2822/4885ALDH1A1 2195/4885
US-20230303512-A1 MODULATORS OF MYB-MEDIATED TRANSCRIPTION AND USES THEREOF MYB, MYBBP1A, MYCBP TRIM24 220/4885TRIM33 1410/4885ALDH1A1 4244/4885
US-20220396583-A1 COMPOUNDS AS MODULATORS OF TLR2 SIGNALING TLR2, TLR4, TLR3 TRIM24 1887/4885TRIM33 3127/4885ALDH1A1 4464/4885

“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.