SCHEMBL12227120

SCHEMBL12227120

CNCCCCC(NC(=O)CCNC)C(N)=O

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 7/20 0.44
▸ ALB P02768 1/20 0.41
▸ TLR2 O60603 1/20 0.41
▸ SIRT5 Q9NXA8 3/20 0.40
▸ GNPAT O15228 1/20 0.37
▸ NMT2 O60551 1/20 0.36
▸ NMT1 P30419 1/20 0.36
▸ ROCK2 O75116 3/20 0.35
▸ PRKACA P17612 1/20 0.35
▸ AKT3 Q9Y243 1/20 0.35
▸ SLC6A5 Q9Y345 1/20 0.35
▸ EPHX2 P34913 1/20 0.35

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
SCHEMBL18174546 0.91 ALB (0.49) NOD1ALBTLR2SIRT5ROCK2
SCHEMBL24461841 0.91 ALB (0.49) NOD1ALBTLR2SIRT5ROCK2
SCHEMBL24239462 0.87 ALB (0.44) NOD1ALBTLR2SIRT5NMT2
SCHEMBL24592963 0.86 SIRT5 (0.47) NOD1TLR2SIRT5GNPATNMT2
SCHEMBL25454947 0.84 TLR2 (0.39) NOD1ALBTLR2SIRT5
SCHEMBL21305215 0.84 ALB (0.44) NOD1ALBTLR2SIRT5ROCK2
SCHEMBL14586429 0.83 TLR2 (0.54) NOD1TLR2SIRT5
SCHEMBL24817235 0.83 TLR2 (0.52) TLR2SIRT5NMT2NMT1ROCK2
SCHEMBL22473591 0.81 TLR2 (0.39) NOD1ALBTLR2SIRT5NMT2
SCHEMBL23382257 0.81 NOD1 (0.36) NOD1ALBTLR2SIRT5ROCK2

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-8044174-B2 Peptides and polypeptides which may be used to increase platelets or platelet precursors (e.g., megakaryocytes) in a mammal AMGEN INC. (US) 2011-10-25 — — US disclosed
US-20110071077-A1 Thrombopoietic Compounds AMGEN INC. (US) 2011-03-24 — — US disclosed
US-20090053242-A1 Thrombopoietic compounds AMGEN INC. (US) 2009-02-26 — — US disclosed
US-20070142295-A1 Thrombopoietic compounds AMGEN INC. (US) 2007-06-21 — — 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 (3 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-20090053242-A1 Thrombopoietic compounds MPL, THPO, PDGFA NOD1 4743/4885ALB 1932/4885TLR2 2052/4885
US-20070142295-A1 Thrombopoietic compounds MPL, THPO, PDGFA NOD1 4795/4885ALB 2993/4885TLR2 3064/4885
US-20110071077-A1 Thrombopoietic Compounds MPL, THPO, PDGFA NOD1 4743/4885ALB 1932/4885TLR2 2052/4885

“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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