SCHEMBL16647657

SCHEMBL16647657

CC(C)(O)CCOc1ccc(-c2cc(COc3cc4c(cn3)[C@H]3[C@@H](C4)[C@@H]3C(=O)O)c(F)cc2C(F)(F)F)c(F)c1

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.50
CYP2C8 P10632 1/20 0.32
CYP2C9 P11712 1/20 0.32
S1PR1 P21453 1/20 0.30
PRKX P51817 1/20 0.30
IKBKE Q14164 1/20 0.30
S1PR5 Q9H228 1/20 0.30
FFAR4 Q5NUL3 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
SCHEMBL16637224 0.94 FFAR1 (0.54) FFAR1CYP2C8CYP2C9
SCHEMBL17925138 0.94 FFAR1 (0.54) FFAR1CYP2C8CYP2C9
SCHEMBL16647619 0.92 FFAR1 (0.49) FFAR1CYP2C8CYP2C9
SCHEMBL17925140 0.92 FFAR1 (0.54) FFAR1CYP2C8CYP2C9S1PR1FFAR4
SCHEMBL16637065 0.92 FFAR1 (0.54) FFAR1CYP2C8CYP2C9S1PR1FFAR4
SCHEMBL17930524 0.91 FFAR1 (0.55) FFAR1CYP2C8CYP2C9
SCHEMBL16647617 0.91 FFAR1 (0.53) FFAR1CYP2C8CYP2C9
SCHEMBL15471396 0.89 FFAR1 (0.58) FFAR1CYP2C8CYP2C9FFAR4
SCHEMBL16647648 0.89 FFAR1 (0.55) FFAR1CYP2C8CYP2C9FFAR4
SCHEMBL16647620 0.89 FFAR1 (0.55) FFAR1CYP2C8CYP2C9FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3055288-B1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME (US) 2020-12-16 EP claimed
EP-3055288-B1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME (US) 2020-12-16 EP disclosed
EP-3055288-B1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME (US) 2020-12-16 EP disclosed
US-9932311-B2 Antidiabetic tricyclic compounds MERCK SHARP & DOHME CORP. (US) 2018-04-03 US disclosed
US-20160207887-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME LLC 2016-07-21 US disclosed
WO-2015051725-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2015-04-16 WO disclosed
WO-2015051496-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS MERCK SHARP & DOHME CORP. (US) 2015-04-16 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 (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-20160207887-A1 ANTIDIABETIC TRICYCLIC COMPOUNDS GPR119, GPR65, GPR55 FFAR1 23/4885CYP2C8 1149/4885CYP2C9 2352/4885

“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.