SCHEMBL5836128

SCHEMBL5836128

CC(C)(C)OC(=O)CNC1(C(=O)O)CCc2ccccc2C1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 2/20 0.48
PYGL P06737 1/20 0.40
CXCR5 P32302 6/20 0.37
PTPRC P08575 2/20 0.36
AVPR2 P30518 1/20 0.36

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
SCHEMBL2813574 0.82 GHSR (0.63) GHSRPYGLCXCR5
SCHEMBL18614234 0.82 GHSR (0.63) GHSRPYGLCXCR5
SCHEMBL29715495 0.82 GHSR (0.63) GHSRPYGLCXCR5
SCHEMBL7432017 0.79 BRD4 (0.41) GHSRCXCR5PTPRCAVPR2
SCHEMBL5835047 0.79 GHSR (0.46) GHSR
SCHEMBL4144700 0.77 CA12 (0.33) PTPRC
SCHEMBL7268200 0.74 PYGL (0.48) GHSRPYGLCXCR5
SCHEMBL7274311 0.73 GHSR (0.52) GHSRPYGLCXCR5
SCHEMBL7274318 0.73 GHSR (0.52) GHSRPYGLCXCR5
SCHEMBL7274308 0.73 GHSR (0.52) GHSRPYGLCXCR5

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-7115767-B2 Tetraline derivatives as ghrelin receptor modulators ABBOTT LABORATORIES (US) 2006-10-03 US disclosed
US-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators ABBVIE INC. 2005-01-20 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-20050014794-A1 Tetraline derivatives as ghrelin receptor modulators GPR119, GHSR, GIPR GHSR 2/4885PYGL 1129/4885CXCR5 1553/4885

“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.