SCHEMBL29879976

SCHEMBL29879976

CCCCCCCCCCCCCCCC(=O)N[C@H](CN)C(=O)OCc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ FAAH O00519 2/20 0.53
▸ EPHX2 P34913 1/20 0.51
▸ SIRT2 Q8IXJ6 4/20 0.50
▸ ITGB3 P05106 1/20 0.50
▸ ITGA2B P08514 1/20 0.50
▸ SIRT1 Q96EB6 3/20 0.49
▸ SIRT3 Q9NTG7 2/20 0.49
▸ ALDH1A1 P00352 1/20 0.49
▸ HPGD P15428 1/20 0.49

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 SCHEMBL8823455 0.99 MEN1 (0.52) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL9390499 0.89 MEN1 (0.54) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL8823462 0.89 MEN1 (0.54) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL9443640 0.89 MEN1 (0.54) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL10338646 0.89 SIRT2 (0.60) SIRT2ITGB3ITGA2BSIRT1SIRT3
SCHEMBL25408743 0.88 EPHX2 (0.52) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL30910821 0.88 EPHX2 (0.52) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL30910825 0.88 EPHX2 (0.52) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL28252274 0.88 MEN1 (0.52) MEN1KMT2AFAAHEPHX2SIRT2
SCHEMBL28252275 0.88 MEN1 (0.52) MEN1KMT2AFAAHEPHX2SIRT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11413352-B2 Conjugate based systems for controlled insulin delivery Merck, Sharp & Dohme LLC (US) 2022-08-16 — — 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-11413352-B2 Conjugate based systems for controlled insulin delivery GPR119, INSR, IGF1R MEN1 2445/4885KMT2A 3489/4885FAAH 541/4885

“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.

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