SCHEMBL25830868

SCHEMBL25830868

CSCc1ccc(NC(=O)[C@H](CCCNC(N)=O)NC(=O)[C@@H](NC(=O)CCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCC(C)C)C(C)C)cc1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FURIN P09958 3/20 0.36
▸ NPY1R P25929 5/20 0.35
▸ NPY4R P50391 5/20 0.35
▸ NPY5R Q15761 4/20 0.35
▸ NPY2R P49146 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ OPRK1 P41145 2/20 0.34
▸ GLP1R P43220 3/20 0.34
▸ CA12 O43570 2/20 0.33
▸ CA1 P00915 2/20 0.33
▸ CA2 P00918 2/20 0.33
▸ CA4 P22748 2/20 0.33
▸ CA9 Q16790 2/20 0.33
▸ CA14 Q9ULX7 2/20 0.33

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
SCHEMBL22702633 0.92 TRPV1 (0.38) FURINNPY1RNPY4RNPY5RNPY2R
SCHEMBL22702532 0.90 FURIN (0.38) FURINNPY1RNPY4RHTTOPRK1
SCHEMBL25826704 0.87 SIRT2 (0.37) FURINNPY1RNPY4RHTT
SCHEMBL22138371 0.86 FURIN (0.44) FURINNPY1RNPY4RHTTGLP1R
SCHEMBL24591729 0.86 GLP1R (0.39) FURINNPY1RNPY4RNPY5RNPY2R
SCHEMBL19359701 0.84 FURIN (0.39) FURINNPY1RNPY4RNPY5RNPY2R
SCHEMBL22702534 0.84 TRPV1 (0.39) FURINNPY1RNPY4RNPY5RNPY2R
SCHEMBL22702667 0.83 FURIN (0.40) FURINNPY1RNPY4RNPY5RNPY2R
SCHEMBL24829575 0.83 SIRT1 (0.41) FURINHTT
SCHEMBL21153498 0.83 SIRT2 (0.38) FURINNPY1RNPY4RHTT

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-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2023-09-14 — — US disclosed
US-11701427-B2 Diels-alder conjugation methods REGENERON PHARMACEUTICALS, INC. (US) 2023-07-18 — — 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 (2 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-11701427-B2 Diels-alder conjugation methods GLUL, TGM2, GLS FURIN 826/4885NPY1R 3105/4885NPY4R 2169/4885
US-20230285581-A1 RIFAMYCIN ANALOGS AND ANTIBODY-DRUG CONJUGATES THEREOF ASGR1, CUTA, SRPRA FURIN 794/4885NPY1R 2542/4885NPY4R 4005/4885

“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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