SCHEMBL5835274

SCHEMBL5835274

CC(C)COC(=O)NC1(C(=O)O)CCc2ccccc2C1

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.65
CXCR5 P32302 6/20 0.45
PYGL P06737 1/20 0.42
DRD2 P14416 1/20 0.40
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
LMNA P02545 1/20 0.39

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
SCHEMBL5836521 0.89 GHSR (0.64) GHSRCXCR5DRD2KDM4EALDH1A1
SCHEMBL5834736 0.88 GHSR (0.60) GHSRCXCR5DRD2KDM4EALDH1A1
SCHEMBL7274308 0.86 GHSR (0.52) GHSRCXCR5PYGL
SCHEMBL7274311 0.86 GHSR (0.52) GHSRCXCR5PYGL
SCHEMBL7274318 0.86 GHSR (0.52) GHSRCXCR5PYGL
SCHEMBL5835360 0.85 GHSR (0.50) GHSRCXCR5PYGL
SCHEMBL5835522 0.84 GHSR (0.49) GHSRCXCR5KDM4E
SCHEMBL5834973 0.84 GHSR (0.68) GHSRCXCR5KDM4ELMNA
SCHEMBL5835834 0.84 GHSR (0.54) GHSRCXCR5DRD2KDM4E
SCHEMBL5835214 0.83 GHSR (0.53) GHSRCXCR5KDM4EALDH1A1

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 1553/4885PYGL 1129/4885

“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.