SCHEMBL22266609

SCHEMBL22266609

CC(C)CC(C)(C)C(=O)N[C@@H](CCCCN)C(=O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ FOLH1 Q04609 1/20 0.36
▸ CTSK P43235 1/20 0.36
▸ NMT2 O60551 1/20 0.35
▸ NMT1 P30419 1/20 0.35
▸ SIRT6 Q8N6T7 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ CPB2 Q96IY4 3/20 0.33
▸ MMP1 P03956 2/20 0.32
▸ MMP3 P08254 2/20 0.32
▸ MMP9 P14780 1/20 0.32
▸ SLC6A5 Q9Y345 1/20 0.32

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
SCHEMBL23615418 0.85 FOLH1 (0.40) FOLH1CTSKNMT2NMT1SIRT6
SCHEMBL14961163 0.77 SIRT6 (0.43) FOLH1NMT2NMT1SIRT6SIRT1
SCHEMBL21566743 0.77 SIRT6 (0.54) FOLH1SIRT6SIRT1
SCHEMBL14961162 0.77 SIRT6 (0.43) FOLH1NMT2NMT1SIRT6SIRT1
SCHEMBL16557402 0.77 SIRT6 (0.54) FOLH1SIRT6SIRT1
SCHEMBL23053207 0.75 NMT1 (0.43) FOLH1NMT2NMT1SIRT6SIRT1
SCHEMBL31015746 0.74 FOLH1 (0.49) FOLH1CPB2SLC6A5
SCHEMBL24453587 0.73 NMT2 (0.37) FOLH1NMT2NMT1SIRT6SIRT1
SCHEMBL23682447 0.73 NMT2 (0.37) FOLH1NMT2NMT1SIRT6SIRT1
SCHEMBL20435279 0.73 FOLH1 (0.41) FOLH1NMT2NMT1SIRT6SIRT1

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-10723776-B1 Apelin peptides and uses thereof THE GOVERNERS OF THE UNIVERSITY OF ALBERTA (CA) 2020-07-28 — — 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-10723776-B1 Apelin peptides and uses thereof APLNR, MME, ANPEP FOLH1 327/4885CTSK 150/4885NMT2 1585/4885

“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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