SCHEMBL31680256

SCHEMBL31680256

N=C(N)NCCC[C@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](Cc1ccc(O)cc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](N)Cc1ccccc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ NPY4R P50391 13/20 0.57
▸ NPY1R P25929 8/20 0.57
▸ NPY2R P49146 6/20 0.57
▸ NPY5R Q15761 6/20 0.57
▸ KEAP1 Q14145 1/20 0.51
▸ TFPI P10646 1/20 0.51
▸ EIF4E P06730 1/20 0.50
▸ EIF4EBP1 Q13541 1/20 0.50
▸ VIPR2 P41587 3/20 0.50
▸ VIPR1 P32241 1/20 0.50

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
SCHEMBL30143658 0.94 NPY4R (0.63) NPY4RNPY1RNPY2RNPY5R
SCHEMBL30608889 0.94 NPY4R (0.63) NPY4RNPY1RNPY2RNPY5R
SCHEMBL7119652 0.94 NPY4R (0.63) NPY4RNPY1RNPY2RNPY5R
SCHEMBL7119638 0.94 NPY4R (0.63) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29625340 0.94 NPY4R (0.63) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29641074 0.94 NPY4R (0.63) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29628209 0.94 NPY4R (0.52) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29461992 0.93 NPY4R (0.63) NPY4RNPY1RNPY2RNPY5RTFPI
SCHEMBL29540161 0.92 NPY4R (0.66) NPY4RNPY1RNPY2RNPY5R
SCHEMBL29628241 0.92 NPY4R (0.49) NPY4RNPY1RNPY2RNPY5R

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-20250276116-A1 METHODS OF MITIGATING MYOCARDIAL DAMAGE DUE TO EXTRACORPOREAL MEMBRANE OXYGENATION TUFTS MEDICAL CENTER, INC. 2025-09-04 — — 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-20250276116-A1 METHODS OF MITIGATING MYOCARDIAL DAMAGE DUE TO EXTRACORPOREAL MEMBRANE OXYGENATION TNNI3, TNNT2, MB NPY4R 4783/4885NPY1R 4818/4885NPY2R 4654/4885

“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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