SCHEMBL6397408

SCHEMBL6397408

O=C(SC1CCN(C2Cc3ccccc3C2)C1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.46
BCHE P06276 8/20 0.44
ACHE P22303 1/20 0.44
SLC18A3 Q16572 2/20 0.44
ALDH1A1 P00352 3/20 0.42
GAA P10253 1/20 0.41
KDM4E B2RXH2 2/20 0.41
NPSR1 Q6W5P4 1/20 0.41

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
SCHEMBL6397400 1.00 GRIN2B (0.46) GRIN2BBCHEACHESLC18A3ALDH1A1
SCHEMBL6398778 0.86 KDM4E (0.48) SLC18A3ALDH1A1KDM4E
SCHEMBL6398787 0.86 KDM4E (0.48) SLC18A3ALDH1A1KDM4E
SCHEMBL6397839 0.78 ACHE (0.39) ACHESLC18A3ALDH1A1
SCHEMBL6396689 0.77 SIGMAR1 (0.37) ACHEALDH1A1KDM4E
SCHEMBL6397687 0.74 ACHE (0.54) ACHESLC18A3KDM4E
SCHEMBL6397681 0.74 ACHE (0.54) ACHESLC18A3KDM4E
SCHEMBL6404810 0.71 ALDH1A1 (0.48) GRIN2BBCHEACHEALDH1A1GAA
SCHEMBL6404814 0.71 ALDH1A1 (0.48) GRIN2BBCHEACHEALDH1A1GAA
SCHEMBL6398075 0.71 KDM4E (0.54) KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050004092-A1 Penem derivatives and antimicrobial agent containing the same DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2005-01-06 US disclosed
EP-0757051-B1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME DAIICHI SUNTORY PHARMA CO LTD (JP) 2003-10-29 EP disclosed
EP-0757051-A1 PENEM DERIVATIVES AND ANTIMICROBIAL AGENT CONTAINING THE SAME SUNTORY LIMITED (JP) 1997-02-05 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 (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-20050004092-A1 Penem derivatives and antimicrobial agent containing the same MRPL21, MRPS2, MRPS28 GRIN2B 1982/4885BCHE 3543/4885ACHE 2285/4885

“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.