SCHEMBL18840120

SCHEMBL18840120

Cc1cc(OCc2ccccc2)cc(C)c1C[C@H](NC(=O)[C@@H](CCCNC(=N)N)NC(=O)OCc1ccccc1)C(=O)N[C@@H](CCCCNC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.52
▸ NPY4R P50391 10/20 0.48
▸ NPY5R Q15761 8/20 0.48
▸ NPY1R P25929 7/20 0.48
▸ NPY2R P49146 5/20 0.48
▸ PTGER4 P35408 2/20 0.47
▸ SIRT2 Q8IXJ6 1/20 0.46

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
SCHEMBL24012348 0.90 PSMB8 (0.53) CTSL
SCHEMBL16870000 0.90 PSMB8 (0.53) CTSL
SCHEMBL21627021 0.89 CTSL (0.48) CTSLPTGER4SIRT2
SCHEMBL16869960 0.89 CTSL (0.48) CTSLPTGER4SIRT2
SCHEMBL16870006 0.89 CTSL (0.51) CTSL
SCHEMBL21627147 0.89 CTSL (0.51) CTSL
SCHEMBL18258324 0.88 NPY4R (0.60) CTSLNPY4RNPY5RNPY1RNPY2R
SCHEMBL18840121 0.87 NPY4R (0.58) NPY4RNPY5RNPY1RNPY2R
SCHEMBL20794744 0.86 CTSL (0.49) CTSLPTGER4SIRT2
SCHEMBL25866171 0.84 NPY4R (0.60) NPY4RNPY5RNPY1RNPY2R

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-20170129920-A1 Process for Preparing D-Arginyl-2,6-Dimethyl-L-Tyrosyl-L-Lysyl-L-Phenylalaninamide FLAMMA S.P.A. (IT) 2017-05-11 — — 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-20170129920-A1 Process for Preparing D-Arginyl-2,6-Dimethyl-L-Tyrosyl-L-Lysyl-L-Phenylalaninamide ARG2, ARGLU1, GLS CTSL 1007/4885NPY4R 1738/4885NPY5R 1583/4885

“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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