SCHEMBL14598309

SCHEMBL14598309

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

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 12/20 0.52
▸ NPY1R P25929 9/20 0.52
▸ NPY5R Q15761 8/20 0.52
▸ NPY2R P49146 5/20 0.52
▸ CTSL P07711 2/20 0.51
▸ GNPAT O15228 1/20 0.51
▸ KISS1R Q969F8 1/20 0.49
▸ SRC P12931 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
SCHEMBL14598310 1.00 NPY4R (0.52) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL18237102 0.95 CTSL (0.56) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL14598308 0.94 CTSL (0.51) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL14598305 0.94 CTSL (0.51) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL14509120 0.93 NPY4R (0.55) NPY4RNPY1RNPY5RNPY2RGNPAT
SCHEMBL18237099 0.87 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL18237218 0.87 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL18237127 0.87 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL16948275 0.87 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RCTSL
SCHEMBL18233929 0.87 NPY4R (0.58) NPY4RNPY1RNPY5RNPY2RCTSL

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 4005/4885NPY1R 4333/4885NPY5R 4351/4885

“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.

Send feedback