SCHEMBL16509067

SCHEMBL16509067

CCCCCCCCCCCCCCCC(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CCCCN)C(=O)NC

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 1/20 0.54
▸ NMT2 O60551 3/20 0.54
▸ NMT1 P30419 3/20 0.54
▸ NPY4R P50391 7/20 0.50
▸ NPY5R Q15761 6/20 0.50
▸ NPY1R P25929 5/20 0.50
▸ NPY2R P49146 3/20 0.50
▸ NPBWR1 P48145 1/20 0.44
▸ PRSS1 P07477 1/20 0.44
▸ FURIN P09958 1/20 0.44

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
SCHEMBL16509060 0.96 NPY4R (0.53) TLR2NMT2NMT1NPY4RNPY5R
SCHEMBL15185866 0.95 NMT1 (0.60) TLR2NMT2NMT1NPY4RNPY5R
SCHEMBL16509056 0.94 NPY4R (0.52) TLR2NMT2NMT1NPY4RNPY5R
SCHEMBL16509019 0.92 NPY4R (0.56) NPY4RNPY5RNPY1RNPY2R
SCHEMBL16507758 0.92 NPY4R (0.55) TLR2NMT2NMT1NPY4RNPY5R
SCHEMBL16976140 0.92 NPY4R (0.58) TLR2NMT2NMT1NPY4RNPY5R
SCHEMBL16976101 0.92 NPY4R (0.58) TLR2NMT2NMT1NPY4RNPY5R
SCHEMBL16976139 0.92 NPY4R (0.58) TLR2NMT2NMT1NPY4RNPY5R
SCHEMBL16509114 0.91 GLP1R (0.48) TLR2NMT2NMT1
SCHEMBL16508995 0.91 NPY4R (0.59) TLR2NMT2NMT1NPY4RNPY5R

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-20110301087-A1 CRF1 RECEPTOR COMPOUNDS ANCHOR THERAPEUTICS, INC. 2011-12-08 — — 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 (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-20110301087-A1 CRF1 RECEPTOR COMPOUNDS CRHR1, CRH, CRHR2 TLR2 934/4885NMT2 4711/4885NMT1 4371/4885

“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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