SCHEMBL7454571

SCHEMBL7454571

O=C1NCCN1/N=C/c1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.44
GAA P10253 6/20 0.44
RAB9A P51151 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
LMNA P02545 2/20 0.41
ALDH1A1 P00352 2/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
NPC1 O15118 4/20 0.38
KDM4E B2RXH2 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
HPGD P15428 1/20 0.38
APOBEC3G Q9HC16 1/20 0.38
ALOX5 P09917 1/20 0.38
MAPK1 P28482 2/20 0.37
ALOX15 P16050 1/20 0.37
TDP1 Q9NUW8 1/20 0.36

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
SCHEMBL7454578 1.00 MAPT (0.44) MAPTGAARAB9ASMN1; SMN2LMNA
SCHEMBL10493472 0.90 MAPT (0.41) MAPTGAARAB9ASMN1; SMN2LMNA
SCHEMBL10493466 0.90 MAPT (0.41) MAPTGAARAB9ASMN1; SMN2LMNA
SCHEMBL11176703 0.85 MAPT (0.41) MAPTGAARAB9ASMN1; SMN2LMNA
SCHEMBL11176701 0.85 MAPT (0.41) MAPTGAARAB9ASMN1; SMN2LMNA
SCHEMBL11368203 0.83 ALDH1A1 (0.45) GAARAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL11368200 0.83 ALDH1A1 (0.45) GAARAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL11355028 0.83 KDM4E (0.52) MAPTSMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL11355023 0.83 KDM4E (0.52) MAPTSMN1; SMN2LMNAALDH1A1KMT2A
SCHEMBL11351129 0.82 MAPT (0.49) MAPTGAARAB9ASMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114531850-B Pharmaceutical composition and kit characterized by containing novel penicillin derivative or salt thereof and at least 1 compound selected from beta-lactamase inhibitory compound and antibacterial compound or salt thereof 富士胶片株式会社 2024-08-06 CN disclosed
CN-111954673-B New penam derivatives or salts thereof, pharmaceutical compositions and uses thereof 富士胶片株式会社 2023-09-05 CN disclosed
CN-114531850-A Pharmaceutical composition and kit characterized by containing novel penicillin derivative or salt thereof and 1 or more compounds selected from beta-lactamase inhibitory compound and antibacterial compound or salt thereof 富士胶片株式会社 2022-05-24 CN disclosed
WO-2021066149-A1 PHARMACEUTICAL COMPOSITION AND KIT CHARACTERIZED BY CONTAINING NOVEL PENAM DERIVATIVE OR SALT THEREOF AND ONE OR MORE COMPOUNDS SELECTED FROM Β-LACTAMASE INHIBITOR COMPOUND, ANTIBACTERIAL COMPOUND AND SALTS OF THESE 富士フイルム株式会社 2021-04-08 WO disclosed
US-20210024543-A1 NOVEL PENAM DERIVATIVE OR SALT THEREOF, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS THEREOF FUJIFILM CORPORATION (JP) 2021-01-28 US disclosed
CN-111954673-A Novel penam derivative or salt thereof, pharmaceutical composition, and use thereof 富士胶片株式会社 2020-11-17 CN disclosed
WO-2019194306-A1 NOVEL PENAM DERIVATIVES OR SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF 富士フイルム株式会社 2019-10-10 WO disclosed
WO-2019194306-A1 NOVEL PENAM DERIVATIVES OR SALTS THEREOF, PHARMACEUTICAL COMPOSITIONS AND USE THEREOF 富士フイルム株式会社 2019-10-10 WO disclosed
EP-0891976-B1 Novel cyclic ureas useful as antiarrhythmic and antifibrillatory agents PROCTER & GAMBLE PHARMA (US) 2002-10-16 EP disclosed
US-6083945-A USEFUL IN TREATING HUMANS OR OTHER MAMMALS WITH CARDIAC ARRHYTHMIA AND/OR CARDIAC FIBRILLATION THE PROCTER & GAMBLE COMPANY (US) 2000-07-04 US disclosed
EP-0598046-B1 CYCLIC UREAS USEFUL AS ANTIARRHYTHMIC AND ANTIFIBRILLATORY AGENTS PROCTER & GAMBLE PHARMA (US) 1999-03-24 EP disclosed
EP-0891976-A1 Novel cyclic ureas useful as antiarrhythmic and antifibrillatory agents PROCTER & GAMBLE PHARMACEUTICALS (US) 1999-01-20 EP disclosed
US-5691369-A CARDIOVASCULAR DISORDERS THE PROCTOR & GAMBLE COMPANY (US) 1997-11-25 US disclosed
EP-0598046-A1 NOVEL CYCLIC UREAS USEFUL AS ANTIARRHYTHMIC AND ANTIFIBRILLATORY AGENTS PROCTER & GAMBLE PHARMACEUTICALS (US) 1994-05-25 EP disclosed
WO-1993004060-A1 NOVEL CYCLIC UREAS USEFUL AS ANTIARRHYTHMIC AND ANTIFIBRILLATORY AGENTS PROCTER & GAMBLE PHARMACEUTICALS (US) 1993-03-04 WO disclosed
US-4099001-A [[[Imidazolidinyl amino]carbonyl]amino]acetyl cephalosporin derivatives E. R. SQUIBB & SONS, INC. (US) 1978-07-04 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 (1 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-20210024543-A1 NOVEL PENAM DERIVATIVE OR SALT THEREOF, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS THEREOF CFTR, SLC11A2, SLC20A1 MAPT 1941/4885GAA 366/4885RAB9A 757/4885

“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.