SCHEMBL17948330

SCHEMBL17948330

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

nearest known ligand 0.46

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ KISS1R Q969F8 8/20 0.46
▸ NPY4R P50391 8/20 0.42
▸ NPY1R P25929 6/20 0.42
▸ NPY2R P49146 4/20 0.42
▸ NPY5R Q15761 4/20 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
SCHEMBL31422680 0.89 KISS1R (0.47) KISS1RNPY4R
SCHEMBL30092982 0.86 NPY4R (0.48) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL31307247 0.85 KISS1R (0.49) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL17948378 0.85 KISS1R (0.49) KISS1R
SCHEMBL31307257 0.84 KISS1R (0.50) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL30140921 0.84 TFPI (0.48) —
SCHEMBL16509013 0.83 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30350530 0.82 NPY4R (0.47) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL31307230 0.82 KISS1R (0.48) KISS1RNPY4RNPY1RNPY2RNPY5R
SCHEMBL30924751 0.81 TFPI (0.44) KISS1RNPY4RNPY1RNPY2RNPY5R

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-20160215033-A1 Granulocyte Macrophage Colony-Stimulating Factor Compositions SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 2016-07-28 — — 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-20160215033-A1 Granulocyte Macrophage Colony-Stimulating Factor Compositions CSF3R, CSF1R, GMFG KISS1R 3793/4885NPY4R 3582/4885NPY1R 4349/4885

“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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