SCHEMBL5835360

SCHEMBL5835360

CC(C)COC(=O)NC1(C(=O)O)CCc2cc(Br)ccc2C1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.50
SLC18A2 Q05940 3/20 0.36
CXCR5 P32302 9/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
AAK1 Q2M2I8 2/20 0.34
PYGL P06737 1/20 0.33

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
SCHEMBL5835522 0.86 GHSR (0.49) GHSRSLC18A2CXCR5SMN1; SMN2
SCHEMBL5835274 0.85 GHSR (0.65) GHSRCXCR5PYGL
SCHEMBL5835380 0.81 GHSR (0.79) GHSRSMN1; SMN2
SCHEMBL5835476 0.81 GHSR (0.79) GHSRSMN1; SMN2
SCHEMBL5835834 0.80 GHSR (0.54) GHSRSLC18A2CXCR5
SCHEMBL5834973 0.75 GHSR (0.68) GHSRSLC18A2CXCR5
SCHEMBL5836521 0.75 GHSR (0.64) GHSRCXCR5SMN1; SMN2
SCHEMBL5835214 0.74 GHSR (0.53) GHSRSLC18A2CXCR5SMN1; SMN2
SCHEMBL5834736 0.74 GHSR (0.60) GHSRCXCR5SMN1; SMN2AAK1
SCHEMBL24000183 0.73 HSD17B3 (0.38) CXCR5PYGL

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 2/4885SLC18A2 653/4885CXCR5 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.