SCHEMBL18712623

SCHEMBL18712623

CC[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)CCSSC[C@@H](C(=O)N[C@H](C(N)=O)[C@@H](C)O)NC1=O

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ SSTR5 P35346 4/20 0.50
▸ SSTR2 P30874 3/20 0.50
▸ SSTR1 P30872 1/20 0.50
▸ SSTR3 P32745 1/20 0.50
▸ DDOST P39656 1/20 0.48
▸ UTS2R Q9UKP6 4/20 0.47
▸ OXTR P30559 1/20 0.47
▸ NTSR2 O95665 1/20 0.45
▸ SRC P12931 1/20 0.44
▸ CD2 P06729 1/20 0.43
▸ CD58 P19256 1/20 0.43
▸ CACNA1B Q00975 1/20 0.43

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 0.89 SSTR2 (0.54) SSTR5SSTR2SSTR1SSTR3UTS2R
SCHEMBL20963290 0.88 SSTR2 (0.48) SSTR5SSTR2SSTR1SSTR3UTS2R
SCHEMBL19543950 0.79 SSTR2 (0.61) SSTR5SSTR2SSTR1SSTR3
SCHEMBL18712329 0.78 SSTR2 (0.61) SSTR5SSTR2SSTR1SSTR3
SCHEMBL20465864 0.78 CACNA1B (0.50) SSTR5SSTR2SSTR1SSTR3OXTR
SCHEMBL21312758 0.77 OXTR (0.58) SSTR5SSTR2SSTR1SSTR3OXTR
SCHEMBL22844368 0.77 OXTR (0.58) SSTR5SSTR2SSTR1SSTR3OXTR
SCHEMBL18712893 0.77 SSTR2 (0.70) SSTR5SSTR2SSTR1SSTR3
SCHEMBL23968131 0.76 OXTR (0.59) SSTR5SSTR2OXTRSRCCD2
SCHEMBL22891909 0.76 OXTR (0.59) SSTR5SSTR2OXTRSRCCD2

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-9750818-B2 Targeted conjugates and particles and formulations thereof TARVEDA THERAPEUTICS, INC. (US) 2017-09-05 — — US disclosed
US-20170095569-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF TVA (ABC), LLC 2017-04-06 — — 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-20170095569-A1 TARGETED CONJUGATES AND PARTICLES AND FORMULATIONS THEREOF SSTR5, SSTR1, SSTR4 SSTR5 1/4885SSTR2 4/4885SSTR1 2/4885

“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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