SCHEMBL13839054

SCHEMBL13839054

NCCOCCOCCNC(=O)C(CCCCNC1CC1)NC1CC1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 2/20 0.40
▸ MEN1 O00255 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ SIRT6 Q8N6T7 1/20 0.35
▸ SIRT1 Q96EB6 1/20 0.35
▸ GLP1R P43220 8/20 0.34
▸ EPOR P19235 1/20 0.34
▸ CA2 P00918 1/20 0.33
▸ CPB2 Q96IY4 1/20 0.33
▸ NMT1 P30419 4/20 0.32
▸ NMT2 O60551 3/20 0.32
▸ FOLH1 Q04609 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
SCHEMBL12196382 0.88 MEN1 (0.38) TLR2MEN1KMT2ASIRT6SIRT1
SCHEMBL12196491 0.87 TLR2 (0.36) TLR2MEN1KMT2ASIRT6SIRT1
SCHEMBL12706048 0.87 MEN1 (0.38) TLR2MEN1KMT2ASIRT6SIRT1
SCHEMBL13839052 0.83 SIRT6 (0.44) TLR2MEN1KMT2ASIRT6SIRT1
SCHEMBL12196488 0.74 TLR2 (0.43) TLR2MEN1KMT2ASIRT6SIRT1
SCHEMBL10132076 0.73 METAP1 (0.36) —
SCHEMBL14586327 0.73 TLR2 (0.45) TLR2MEN1KMT2ASIRT6SIRT1
SCHEMBL12766489 0.70 SMN1; SMN2 (0.36) KMT2ASIRT6SIRT1FOLH1
SCHEMBL18760223 0.70 SMN1; SMN2 (0.52) CPB2NMT1NMT2
SCHEMBL14078185 0.70 TLR2 (0.45) TLR2MEN1KMT2ASIRT6SIRT1

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-7528104-B2 Peptides that bind to the erythropoietin receptor AFFYMAX, INC. (US) 2009-05-05 — — US disclosed
US-7414105-B2 Peptide dimer bonded to polyethylene glycol through amide groups; insufficient or defective red blood cell production AFFYMAX, INC. (US) 2008-08-19 — — US disclosed
US-20070027074-A1 Novel peptides that bind to the erythropoietin receptor AFFYMAX, INC. (US) 2007-02-01 — — 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-20070027074-A1 Novel peptides that bind to the erythropoietin receptor EPOR, PROKR1, EDNRB TLR2 2680/4885MEN1 3831/4885KMT2A 4517/4885

“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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