SCHEMBL2183888

SCHEMBL2183888

NCCCC[C@H](N)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CS)C(=O)N[C@H]([C]=O)Cc1ccc(O)cc1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CD40 P25942 3/20 0.51
OPRD1 P41143 7/20 0.47
OPRM1 P35372 6/20 0.47
OPRK1 P41145 1/20 0.44
CHRND Q07001 6/20 0.44
CHRNA1 P02708 2/20 0.44
CHRNG P07510 2/20 0.44
CHRNB1 P11230 2/20 0.44
TERT O14746 1/20 0.43
GRIA1 P42261 3/20 0.42

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
SCHEMBL2183041 0.90 NPY4R (0.43) CHRND
SCHEMBL2189511 0.90 NPY4R (0.53) CD40
SCHEMBL2192467 0.88 CD40 (0.46) CD40OPRD1OPRM1OPRK1CHRND
SCHEMBL4672644 0.82 MMP2 (0.48) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL4672649 0.82 MMP2 (0.48) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL2193850 0.81 NPY4R (0.58)
SCHEMBL9333689 0.80 CD40 (0.53) CD40OPRD1OPRM1OPRK1CHRND
SCHEMBL16468664 0.80 NPY4R (0.52) CHRNDCHRNA1CHRNGCHRNB1
SCHEMBL31415945 0.79 CD40 (0.52) CD40OPRD1OPRM1OPRK1
SCHEMBL23362938 0.79 NPY4R (0.56)

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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NEKTAR THERAPEUTICS (US) 2011-07-07 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-20110166063-A1 POLYMER CONJUGATES OF THERAPEUTIC PEPTIDES NGLY1, CD44, IAPP CD40 33/4885OPRD1 3100/4885OPRM1 2317/4885

“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.