SCHEMBL2183443

SCHEMBL2183443

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

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CTSC P53634 5/20 0.55
SLC15A1 P46059 1/20 0.46
LTA4H P09960 1/20 0.44
MME P08473 1/20 0.44
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CTSH P09668 1/20 0.43
CYP2D6 P10635 1/20 0.43
CTSK P43235 1/20 0.43
BACE1 P56817 3/20 0.42
BACE2 Q9Y5Z0 1/20 0.42
OPRD1 P41143 5/20 0.41
OPRM1 P35372 4/20 0.41
OPRK1 P41145 1/20 0.41

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
SCHEMBL11443315 0.90 CTSC (0.63) CTSCSLC15A1LTA4HCYP1A2CYP3A4
SCHEMBL16468683 0.84 CTSC (0.56) CTSCSLC15A1LTA4HCYP1A2CYP3A4
SCHEMBL2183798 0.84 CTSC (0.62) CTSCMMECYP1A2CYP3A4CTSH
SCHEMBL2193162 0.83 CTSC (0.50) CTSCCYP1A2CYP3A4CTSHCYP2D6
SCHEMBL2196355 0.83 CTSC (0.43) CTSCBACE1BACE2OPRD1OPRM1
SCHEMBL9390903 0.82 CTSC (0.59) CTSCSLC15A1LTA4HCYP1A2CYP3A4
SCHEMBL1691349 0.81 CTSC (0.76) CTSCSLC15A1LTA4HCYP1A2CYP3A4
SCHEMBL583122 0.81 CTSC (0.76) CTSCSLC15A1LTA4HCYP1A2CYP3A4
SCHEMBL9389290 0.81 CTSC (0.76) CTSCSLC15A1LTA4HCYP1A2CYP3A4
SCHEMBL583121 0.81 CTSC (0.76) CTSCSLC15A1LTA4HCYP1A2CYP3A4

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 CTSC 331/4885SLC15A1 689/4885LTA4H 2136/4885

“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.