SCHEMBL14598307

SCHEMBL14598307

N=C(N)NCCCC(=O)N[C@H](Cc1ccc(-c2ccccc2)cc1)C(=O)N[C@H](CCC(=O)O)C(N)=O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 11/20 0.57
▸ NPY5R Q15761 10/20 0.57
▸ NPY1R P25929 9/20 0.57
▸ NPY2R P49146 7/20 0.57
▸ MMP2 P08253 1/20 0.51
▸ MMP8 P22894 1/20 0.51
▸ MMP12 P39900 1/20 0.51
▸ MMP13 P45452 1/20 0.51
▸ FOLH1 Q04609 1/20 0.49
▸ MME P08473 1/20 0.48

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
SCHEMBL14598311 1.00 NPY4R (0.57) NPY4RNPY5RNPY1RNPY2RMMP2
SCHEMBL14598296 0.94 NPY4R (0.62) NPY4RNPY5RNPY1RNPY2R
SCHEMBL14598306 0.94 NPY4R (0.62) NPY4RNPY5RNPY1RNPY2R
SCHEMBL5496626 0.89 NPY4R (0.53) NPY4RNPY5RNPY1RNPY2RFOLH1
SCHEMBL5491137 0.89 NPY4R (0.53) NPY4RNPY5RNPY1RNPY2RFOLH1
SCHEMBL5488639 0.88 CHRNB2 (0.53) NPY4RNPY5RNPY1RNPY2RFOLH1
SCHEMBL5487488 0.88 CHRNB2 (0.53) NPY4RNPY5RNPY1RNPY2RFOLH1
SCHEMBL14509120 0.88 NPY4R (0.55) NPY4RNPY5RNPY1RNPY2R
SCHEMBL14509094 0.87 NPY4R (0.60) NPY4RNPY5RNPY1RNPY2RFOLH1
SCHEMBL14531792 0.87 NPY4R (0.60) NPY4RNPY5RNPY1RNPY2RFOLH1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia SIRCAR JAGADISH C 2007-01-04 — — US disclosed
US-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia SIRCAR JAGADISH C 2007-01-04 — — 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-20070004644-A1 Mediators of reverse cholesterol transport for the treatment of hypercholesterolemia CETP, LDLR, NPC1L1 NPY4R 4005/4885NPY5R 4351/4885NPY1R 4333/4885

“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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