SCHEMBL20542964

SCHEMBL20542964

CCCCCCCCCCCCCCCCNC(=O)NC(CCCCN)C(=O)NCCCCCCCCCCCC

nearest known ligand 0.80

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 3/20 0.80
▸ SIRT6 Q8N6T7 1/20 0.80
▸ GNAI3 P08754 1/20 0.65
▸ GNAO1 P09471 1/20 0.65
▸ GNAI1 P63096 1/20 0.65
▸ TLR2 O60603 5/20 0.59
▸ RRM1 P23921 1/20 0.56
▸ EPHX1 P07099 6/20 0.54
▸ DPP7 Q9UHL4 2/20 0.54
▸ SIRT2 Q8IXJ6 2/20 0.52
▸ SIRT3 Q9NTG7 2/20 0.52
▸ NMT2 O60551 1/20 0.48
▸ NMT1 P30419 1/20 0.48
▸ CHRND Q07001 1/20 0.46

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
SCHEMBL20543120 1.00 SIRT1 (0.80) SIRT1SIRT6GNAI3GNAO1GNAI1
SCHEMBL20543122 1.00 SIRT1 (0.80) SIRT1SIRT6GNAI3GNAO1GNAI1
SCHEMBL20542962 1.00 SIRT1 (0.80) SIRT1SIRT6GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL20543112 0.99 SIRT1 (0.78) SIRT1SIRT6GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL20543110 0.99 SIRT1 (0.78) SIRT1SIRT6GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL20543035 0.99 SIRT1 (0.78) SIRT1SIRT6GNAI3GNAO1GNAI1
Hydrochloric Acid SCHEMBL20543034 0.99 SIRT1 (0.78) SIRT1SIRT6GNAI3GNAO1GNAI1
SCHEMBL23835515 0.89 SIRT6 (0.63) SIRT1SIRT6GNAI3GNAO1GNAI1
SCHEMBL2863617 0.89 SIRT6 (0.63) SIRT1SIRT6GNAI3GNAO1GNAI1
SCHEMBL8747456 0.89 SIRT6 (0.63) SIRT1SIRT6GNAI3GNAO1GNAI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180311342-A1 IMMUNOSTIMULATING AGENT AJINOMOTO CO., INC. (JP) 2018-11-01 — — US claimed
EP-3395365-A1 IMMUNOSTIMULATING AGENT AJINOMOTO CO., INC. (JP) 2018-10-31 — — EP claimed
US-20180311342-A1 IMMUNOSTIMULATING AGENT AJINOMOTO CO., INC. (JP) 2018-11-01 — — US disclosed
EP-3395365-A1 IMMUNOSTIMULATING AGENT AJINOMOTO CO., INC. (JP) 2018-10-31 — — 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-20180311342-A1 IMMUNOSTIMULATING AGENT MYD88, TLR9, IL2 SIRT1 1226/4885SIRT6 1830/4885GNAI3 612/4885

“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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