SCHEMBL6450596

SCHEMBL6450596

CC(C)(C)OC(=O)N(C[C@H]1CCc2cc(-c3ccc(C(=O)O)c(Oc4ccccc4)c3Cc3ccccc3)ccc2O1)C[C@H](O[Si](C)(C)C(C)(C)C)c1cccnc1

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.33
SLC8A1 P32418 3/20 0.31
ROCK2 O75116 2/20 0.30
GPR119 Q8TDV5 1/20 0.30
FFAR1 O14842 1/20 0.30

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
SCHEMBL6284136 0.85 GPR119 (0.32) FFAR4SLC8A1ROCK2GPR119
SCHEMBL6284143 0.85 GPR119 (0.32) FFAR4SLC8A1ROCK2GPR119
SCHEMBL6287391 0.83 FFAR4 (0.35) FFAR4SLC8A1ROCK2GPR119FFAR1
SCHEMBL6287396 0.83 FFAR4 (0.35) FFAR4SLC8A1ROCK2GPR119FFAR1
SCHEMBL6283648 0.82 ADRB3 (0.38) FFAR4ROCK2GPR119FFAR1
SCHEMBL6283640 0.82 ADRB3 (0.38) FFAR4ROCK2GPR119FFAR1
SCHEMBL6284029 0.82 FFAR4 (0.35) FFAR4SLC8A1GPR119FFAR1
SCHEMBL6284018 0.82 FFAR4 (0.35) FFAR4SLC8A1GPR119FFAR1
SCHEMBL6280603 0.80 KDM4D (0.34) FFAR4SLC8A1GPR119FFAR1
SCHEMBL6280608 0.80 KDM4D (0.34) FFAR4SLC8A1GPR119FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050215594-A1 2,6-Substituted chroman derivatives useful as beta-3 adrenoreceptor agonists BAYER PHARMACEUTICALS CORPORATION (US) 2005-09-29 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-20050215594-A1 2,6-Substituted chroman derivatives useful as beta-3 adrenoreceptor agonists ADRB3, ADRB2, ADRB1 FFAR4 332/4885SLC8A1 1792/4885ROCK2 2061/4885

“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.