SCHEMBL13640983

SCHEMBL13640983

CCCCCCCCCCCCCCCC(=O)N[C@@H](CCC(=O)NC)C(=O)O

nearest known ligand 0.82

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 14/20 0.82
▸ SLC6A5 Q9Y345 2/20 0.58
▸ FAAH O00519 2/20 0.53
▸ MEN1 O00255 1/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ KMT2A Q03164 1/20 0.53
▸ PLA2G2C Q5R387 1/20 0.51
▸ GLP1R P43220 1/20 0.50

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
SCHEMBL12806962 1.00 NOD1 (0.82) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL8295104 0.90 NOD1 (0.88) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL8292861 0.90 NOD1 (0.88) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL8294528 0.90 NOD1 (0.88) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL12980909 0.89 NOD1 (0.65) NOD1SLC6A5KMT2APLA2G2C
SCHEMBL13641019 0.89 NOD1 (0.65) NOD1SLC6A5KMT2APLA2G2C
SCHEMBL19049825 0.89 NOD1 (0.85) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL19049824 0.89 NOD1 (0.85) NOD1SLC6A5FAAHMEN1MAPK1
SCHEMBL13974161 0.89 NOD1 (0.65) NOD1SLC6A5KMT2APLA2G2C
SCHEMBL19049829 0.89 NOD1 (0.85) NOD1SLC6A5FAAHMEN1MAPK1

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-20200188479-A1 APPARATUS AND METHODS FOR ADMINISTRATION OF A NAUSEOGENIC COMPOUND FROM A DRUG DELIVERY DEVICE INTARCIA IRELAND LIMITED 2020-06-18 — — US disclosed
US-9012398-B2 Acylated exendin-4 compounds NOVO NORDISK A/S (DK) 2015-04-21 — — US disclosed
US-20120283170-A1 Acylated Exendin-4 Compounds NOVO NORDISK A/S (DK) 2012-11-08 — — 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 (2 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-20200188479-A1 APPARATUS AND METHODS FOR ADMINISTRATION OF A NAUSEOGENIC COMPOUND FROM A DRUG DELIVERY DEVICE CRH, OPRL1, LPXN NOD1 2653/4885SLC6A5 527/4885FAAH 37/4885
US-20120283170-A1 Acylated Exendin-4 Compounds GLP1R, VIP, IAPP NOD1 2160/4885SLC6A5 2573/4885FAAH 163/4885

“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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