SCHEMBL16993552

SCHEMBL16993552

COc1cccc(C2CC2COc2cccc(C(CC(=O)O)C3CC3)c2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 20/20 1.00

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
SCHEMBL16993550 1.00 FFAR1 (1.00) FFAR1
SCHEMBL17000376 0.91 FFAR1 (0.84) FFAR1
SCHEMBL12191936 0.84 FFAR1 (0.71) FFAR1
SCHEMBL20103535 0.84 FFAR1 (0.71) FFAR1
SCHEMBL12191933 0.84 FFAR1 (0.71) FFAR1
SCHEMBL16993525 0.83 FFAR1 (1.00) FFAR1
SCHEMBL16993499 0.83 FFAR1 (1.00) FFAR1
SCHEMBL17000311 0.81 FFAR1 (0.84) FFAR1
SCHEMBL22365353 0.81 FFAR1 (0.84) FFAR1
SCHEMBL12193236 0.80 FFAR1 (0.65) FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3102198-B1 ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME (US) 2020-08-26 EP disclosed
EP-3102198-B1 ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME (US) 2020-08-26 EP disclosed
US-10059667-B2 Antidiabetic compounds MERCK SHARP & DOHME CORP. (US) 2018-08-28 US disclosed
EP-3102198-A1 ANTIDIABETIC COMPOUNDS Merck Sharp & Dohme Corp. (US) 2016-12-14 EP disclosed
US-20160332968-A1 ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME LLC 2016-11-17 US disclosed
WO-2015119899-A1 ANTIDIABETIC COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2015-08-13 WO 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 (2 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-20160332968-A1 ANTIDIABETIC COMPOUNDS GPR119, GLP1R, GIPR FFAR1 14/4885
US-10059667-B2 Antidiabetic compounds GPR119, GLP1R, GIPR FFAR1 14/4885

“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.