SCHEMBL22183395

SCHEMBL22183395

C[C@@H](O)C1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCC(=O)NCCNC(=O)CCSSCCC(=O)N(C)[C@@H](C)C(=O)O)N(C)C(=O)[C@H](Cc2ccccc2)NC1=O

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ SSTR2 P30874 15/20 0.59
▸ SSTR4 P31391 15/20 0.59
▸ SSTR5 P35346 14/20 0.59
▸ SSTR3 P32745 12/20 0.59
▸ SSTR1 P30872 6/20 0.59

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
SCHEMBL22183468 0.97 SSTR2 (0.59) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL19543860 0.90 SSTR4 (0.62) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL17404638 0.86 SSTR4 (0.64) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL18712391 0.85 SSTR4 (0.64) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL24347569 0.85 CXCR4 (0.49) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL17404637 0.85 SSTR4 (0.66) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL18712360 0.84 SSTR4 (0.65) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL22183424 0.84 SSTR2 (0.65) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL24347633 0.84 SSTR2 (0.65) SSTR2SSTR4SSTR5SSTR3SSTR1
SCHEMBL24348580 0.83 CXCR4 (0.49) SSTR2SSTR4SSTR5SSTR3SSTR1

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-20200206356-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2020-07-02 — — 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-20200206356-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR5, SSTR1, SSTR4 SSTR2 4/4885SSTR4 3/4885SSTR5 1/4885

“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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