SCHEMBL21914607

SCHEMBL21914607

CCC(=O)N[C@@H](COC1OC(COCCSCC(C)CSCCN)C(OCc2ccccc2)C(OCc2ccccc2)C1OCc1ccccc1)[C@H](O)[C@@H](C)O

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ SSTR1 P30872 6/20 0.44
▸ SSTR2 P30874 6/20 0.44
▸ SSTR4 P31391 6/20 0.44
▸ SSTR3 P32745 6/20 0.44
▸ SSTR5 P35346 6/20 0.44
▸ PTPN1 P18031 6/20 0.43
▸ CDC25B P30305 6/20 0.43
▸ SELP P16109 2/20 0.39
▸ TACR1 P25103 2/20 0.38
▸ ADRB2 P07550 1/20 0.38
▸ PTPN2 P17706 2/20 0.37
▸ PTPN6 P29350 2/20 0.37
▸ PTPN11 Q06124 2/20 0.37

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
SCHEMBL21914162 0.80 SSTR4 (0.67) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL20019605 0.77 SELP (0.59) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL20019557 0.77 SELP (0.59) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL21915005 0.76 SELP (0.43) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL21915001 0.76 SSTR4 (0.51) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL10314149 0.75 PTPN1 (0.49) PTPN1CDC25BSELPPTPN2PTPN6
SCHEMBL21914263 0.74 PTPN1 (0.43) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL21914253 0.74 SELP (0.44) SELP
SCHEMBL21914272 0.73 SSTR1 (0.38) SSTR1SSTR2SSTR4SSTR3SSTR5
SCHEMBL10314146 0.72 SELP (0.52) PTPN1CDC25BSELPPTPN2PTPN6

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-10588962-B2 Carbohydrate-glycolipid conjugate vaccines MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) 2020-03-17 — — 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-10588962-B2 Carbohydrate-glycolipid conjugate vaccines STT3B, STT3A, DDOST SSTR1 3803/4885SSTR2 3510/4885SSTR4 3333/4885

“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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