SCHEMBL25524952

SCHEMBL25524952

CCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1C[C@@H](O)CN1)C(=O)O

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ NMBR P28336 1/20 0.52
▸ GRPR P30550 1/20 0.52
▸ CCKBR P32239 4/20 0.52
▸ CXCR4 P61073 4/20 0.50
▸ GIPR P48546 7/20 0.48
▸ GLP1R P43220 6/20 0.48
▸ TACR1 P25103 1/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ CCKAR P32238 1/20 0.47
▸ NPY1R P25929 1/20 0.47
▸ NPY2R P49146 1/20 0.47
▸ NPY4R P50391 1/20 0.47
▸ NPY5R Q15761 1/20 0.47
▸ GCGR P47871 1/20 0.47
▸ CXCL8 P10145 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
SCHEMBL22018377 0.96 CXCR4 (0.54) CXCR4GIPRGLP1RNPY1RNPY2R
SCHEMBL22018326 0.93 NTSR2 (0.51) NMBRGRPRCXCR4GIPRGLP1R
SCHEMBL25531559 0.93 CXCR4 (0.50) CXCR4GIPRGLP1R
SCHEMBL25524956 0.92 NMUR2 (0.51) —
SCHEMBL25524938 0.90 APLNR (0.44) NPY1RNPY2RNPY4RNPY5R
SCHEMBL25524928 0.90 APLNR (0.45) NPY1RNPY2RNPY4RNPY5R
SCHEMBL25524955 0.89 NMUR2 (0.52) NMBRGRPRNPY1RNPY2RNPY4R
SCHEMBL30933128 0.88 CXCR4 (0.56) CXCR4GIPRGLP1R
SCHEMBL25524962 0.88 NMUR2 (0.46) NPY1RNPY2RNPY4RNPY5R
SCHEMBL22018374 0.88 F2 (0.52) NMBRGRPRGIPRGLP1RGCGR

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-20230146455-A1 TREATMENT OF INFLAMMATORY DISEASES WITH PEPTIDES AND PHARMACEUTICAL COMPOSITIONS YUYU PHARMA, INC. (KR) 2023-05-11 — — 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-20230146455-A1 TREATMENT OF INFLAMMATORY DISEASES WITH PEPTIDES AND PHARMACEUTICAL COMPOSITIONS VIP, TSLP, IAPP NMBR 1197/4885GRPR 35/4885CCKBR 430/4885

“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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