SCHEMBL22821587

SCHEMBL22821587

CCCCCCCCCCC(=O)NC(CCCCN)C(N)=O

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ SLC6A5 Q9Y345 3/20 0.67
▸ TLR2 O60603 1/20 0.62
▸ NOD1 Q9Y239 5/20 0.57
▸ DNM1 Q05193 1/20 0.54
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ FAAH O00519 2/20 0.51
▸ MAPK1 P28482 1/20 0.51
▸ SIRT6 Q8N6T7 1/20 0.51
▸ SIRT1 Q96EB6 1/20 0.51
▸ NMT2 O60551 2/20 0.50
▸ NMT1 P30419 2/20 0.50
▸ ITGB3 P05106 1/20 0.49
▸ ITGA2B P08514 1/20 0.49
▸ CTSL P07711 1/20 0.48
▸ PLA2G2C Q5R387 1/20 0.47

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
SCHEMBL9664216 1.00 SLC6A5 (0.67) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL9666267 1.00 SLC6A5 (0.67) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL5693676 1.00 SLC6A5 (0.67) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL9664106 1.00 SLC6A5 (0.67) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL12640054 1.00 SLC6A5 (0.67) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL18735588 1.00 SLC6A5 (0.67) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL9666062 0.98 SLC6A5 (0.65) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL9666100 0.95 SLC6A5 (0.61) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL22821589 0.95 SLC6A5 (0.61) SLC6A5TLR2NOD1DNM1MEN1
SCHEMBL9667026 0.95 SLC6A5 (0.61) SLC6A5TLR2NOD1DNM1MEN1

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-20200399308-A1 COMPOUNDS AND METHODS FOR ELICITING ANTIMICROBIAL ACTIVITY TECHNION RESEARCH & DEVELOPMENT FOUNDATION LIMITED (IL) 2020-12-24 — — 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-20200399308-A1 COMPOUNDS AND METHODS FOR ELICITING ANTIMICROBIAL ACTIVITY CD14, MYD88, SLC11A2 SLC6A5 4228/4885TLR2 20/4885NOD1 49/4885

“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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