SCHEMBL5835880

SCHEMBL5835880

CC(C)(C)COC(=O)NC1(C(=O)O)CCc2cccc(Cl)c2C1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.52
CXCR5 P32302 7/20 0.37
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
ADRA2A P08913 2/20 0.34
TAAR1 Q96RJ0 1/20 0.34
ADRA2B P18089 1/20 0.34
ADRA2C P18825 1/20 0.34
ADRA1D P25100 1/20 0.34
ADRA1A P35348 1/20 0.34
ADRA1B P35368 1/20 0.34
AAK1 Q2M2I8 1/20 0.32
PYGL P06737 1/20 0.32

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
SCHEMBL5834973 0.86 GHSR (0.68) GHSRCXCR5TAAR1
SCHEMBL5836247 0.82 GHSR (0.79) GHSR
SCHEMBL5835442 0.82 GHSR (0.79) GHSR
SCHEMBL5835587 0.79 GHSR (0.63) GHSR
SCHEMBL5834813 0.79 GHSR (0.63) GHSR
SCHEMBL5835834 0.73 GHSR (0.54) GHSRCXCR5
SCHEMBL8581652 0.73 GHSR (0.48) GHSRCXCR5PYGL
SCHEMBL1162409 0.73 GHSR (0.48) GHSRCXCR5PYGL
SCHEMBL1162415 0.73 GHSR (0.48) GHSRCXCR5PYGL
SCHEMBL8583599 0.72 CTSS (0.44) GHSRCXCR5

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 2/4885CXCR5 1553/4885DPP8 684/4885

“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.