SCHEMBL2198039

SCHEMBL2198039

NCCCC[C@H](NC(=O)[C@@H](N)CC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@H]([C]=O)Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 2/20 0.53
▸ ACE P12821 3/20 0.49
▸ STAT6 P42226 1/20 0.49
▸ OPRK1 P41145 1/20 0.48
▸ OPRM1 P35372 1/20 0.47
▸ NMUR2 Q9GZQ4 1/20 0.47
▸ NMUR1 Q9HB89 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
SCHEMBL9450535 0.87 ACE (0.54) F2ACESTAT6OPRK1
SCHEMBL29666779 0.85 ACE (0.62) F2ACEOPRK1
SCHEMBL7477934 0.84 ACE (0.56) F2ACESTAT6OPRK1OPRM1
SCHEMBL9450538 0.83 ACE (0.54) F2ACESTAT6OPRK1OPRM1
SCHEMBL7464019 0.82 ACE (0.53) F2ACEOPRK1OPRM1
SCHEMBL7463168 0.82 OPRK1 (0.60) F2ACEOPRK1OPRM1
SCHEMBL9710298 0.82 ACE (0.51) F2ACESTAT6OPRK1
SCHEMBL9450537 0.81 OPRK1 (0.54) F2ACESTAT6OPRK1OPRM1
SCHEMBL7473007 0.81 ACE (0.52) F2ACESTAT6OPRK1OPRM1
SCHEMBL31473057 0.81 OPRM1 (0.53) F2ACEOPRK1OPRM1NMUR2

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-9173951-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2015-11-03 — — US disclosed
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2015-02-19 — — US disclosed
US-8680263-B2 Carbohydrate-based drug delivery polymers and conjugates thereof NEKTAR THERAPEUTICS (US) 2014-03-25 — — US disclosed
US-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF NEKTAR THERAPEUTICS (US) 2011-07-14 — — 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-20110171716-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST F2 3457/4885ACE 1033/4885STAT6 4513/4885
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST F2 3457/4885ACE 1033/4885STAT6 4513/4885

“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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