SCHEMBL17535705

SCHEMBL17535705

CCOc1c(C(=O)OC)cc(C2CC2)c(-c2ccc(F)cc2)c1Cl

nearest known ligand 0.46

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 18/20 0.46
SLC6A4 P31645 2/20 0.40
SLC6A3 Q01959 2/20 0.40
KCNH2 Q12809 2/20 0.38

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
SCHEMBL17535715 0.89 SSTR5 (0.44) SSTR5SLC6A4SLC6A3
SCHEMBL17535520 0.88 SSTR5 (0.45) SSTR5SLC6A4SLC6A3KCNH2
SCHEMBL17535388 0.87 SLC6A4 (0.40) SSTR5SLC6A4SLC6A3KCNH2
SCHEMBL17535828 0.87 SLC6A4 (0.40) SSTR5SLC6A4SLC6A3KCNH2
SCHEMBL17535469 0.87 SSTR5 (0.37) SSTR5SLC6A3KCNH2
SCHEMBL16616292 0.85 SLC6A3 (0.40) SSTR5SLC6A4SLC6A3
SCHEMBL17535817 0.83 SLC6A3 (0.44) SSTR5SLC6A4SLC6A3
SCHEMBL16056254 0.79 TDP1 (0.35) SLC6A3
SCHEMBL17535719 0.79 SSTR5 (0.44) SSTR5KCNH2
SCHEMBL23459274 0.77 SLC6A3 (0.46) SSTR5SLC6A4SLC6A3KCNH2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2970331-B1 SPIRO AZETIDINE ISOXAZOLE DERIVATIVES AND THEIR USE AS SSTR5 ANTAGONISTS TAKEDA PHARMACEUTICALS CO (JP) 2017-05-17 EP disclosed
US-9605000-B2 Spiro azetidine isoxazole derivatives and their use as SSTR antagonists TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2017-03-28 US disclosed
US-20160060273-A1 HETEROCYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-03-03 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-20160060273-A1 HETEROCYCLIC COMPOUND SSTR5, SSTR1, SSTR2 SSTR5 1/4885SLC6A4 88/4885SLC6A3 143/4885

“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.