SCHEMBL2193162

SCHEMBL2193162

C[C@@H](O)[C@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N[C@@H](CO)C(=O)N[C@H]([C]=O)CC(=O)O

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CTSC P53634 3/20 0.50
OPRM1 P35372 4/20 0.47
OPRD1 P41143 4/20 0.47
OPRK1 P41145 1/20 0.46
KISS1R Q969F8 3/20 0.45
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CTSH P09668 1/20 0.42
CYP2D6 P10635 1/20 0.42
CTSK P43235 1/20 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
SCHEMBL2193224 0.92 OPRM1 (0.50) CTSCOPRM1OPRD1OPRK1KISS1R
SCHEMBL19245623 0.88 OPRM1 (0.51) CTSCOPRM1OPRD1OPRK1KISS1R
SCHEMBL29860101 0.88 OPRM1 (0.52) OPRM1OPRD1OPRK1KISS1R
SCHEMBL30124216 0.85 OPRM1 (0.52) OPRM1OPRD1
SCHEMBL29386466 0.83 MME (0.53) CTSCOPRM1OPRD1OPRK1KISS1R
SCHEMBL2183397 0.83 ALDH1A1 (0.43) CTSCOPRM1OPRD1OPRK1CYP1A2
SCHEMBL30122958 0.83 KISS1R (0.53) OPRM1OPRD1OPRK1KISS1R
SCHEMBL11596134 0.83 CTSC (0.66) CTSCCYP1A2CYP3A4CTSHCYP2D6
SCHEMBL2183443 0.83 CTSC (0.55) CTSCOPRM1OPRD1OPRK1CYP1A2
SCHEMBL31215110 0.82 OPRM1 (0.56) CTSCOPRM1OPRD1OPRK1KISS1R

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 CTSC 383/4885OPRM1 3352/4885OPRD1 3859/4885
US-20150051371-A1 CARBOHYDRATE-BASED DRUG DELIVERY POLYMERS AND CONJUGATES THEREOF STT3B, STT3A, DDOST CTSC 383/4885OPRM1 3352/4885OPRD1 3859/4885

“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.