SCHEMBL20465864

SCHEMBL20465864

C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CCc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(N)=O)NC1=O

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CACNA1B Q00975 1/20 0.50
▸ SSTR4 P31391 13/20 0.48
▸ SSTR2 P30874 12/20 0.48
▸ SSTR5 P35346 11/20 0.48
▸ SSTR3 P32745 11/20 0.48
▸ SSTR1 P30872 5/20 0.48
▸ OXTR P30559 1/20 0.46
▸ LDLR P01130 4/20 0.46
▸ PCSK9 Q8NBP7 4/20 0.46

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
SCHEMBL26814255 0.83 SSTR2 (0.54) SSTR4SSTR2SSTR5SSTR3SSTR1
SCHEMBL20963290 0.83 SSTR2 (0.48) CACNA1BSSTR4SSTR2SSTR5SSTR3
SCHEMBL21312758 0.82 OXTR (0.58) CACNA1BSSTR4SSTR2SSTR5SSTR3
SCHEMBL22844368 0.82 OXTR (0.58) CACNA1BSSTR4SSTR2SSTR5SSTR3
SCHEMBL20465794 0.81 SSTR2 (0.70) SSTR4SSTR2SSTR5SSTR3SSTR1
SCHEMBL21892055 0.81 SSTR2 (0.70) SSTR4SSTR2SSTR5SSTR3SSTR1
SCHEMBL22183489 0.80 SSTR2 (0.69) SSTR4SSTR2SSTR5SSTR3SSTR1
SCHEMBL19543950 0.78 SSTR2 (0.61) SSTR4SSTR2SSTR5SSTR3SSTR1
SCHEMBL18712623 0.78 SSTR5 (0.50) CACNA1BSSTR2SSTR5SSTR3SSTR1
SCHEMBL23968131 0.77 OXTR (0.59) SSTR2SSTR5OXTR

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-11160871-B2 SSTR-targeted conjugates and particles and formulations thereof TARVEDA THERAPEUTICS, INC. (US) 2021-11-02 — — US disclosed
US-20180221499-A1 SSTR-TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2018-08-09 — — 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-20180221499-A1 SSTR-TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR1, SSTR4, SSTR3 CACNA1B 4481/4885SSTR4 2/4885SSTR2 5/4885
US-11160871-B2 SSTR-targeted conjugates and particles and formulations thereof SSTR1, SSTR4, SSTR3 CACNA1B 4481/4885SSTR4 2/4885SSTR2 5/4885

“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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