SCHEMBL1708245

SCHEMBL1708245

COC(=O)C[C@@H]1COc2cc(NCc3cccc(-n4c(C)nc5c(C)cccc54)c3C)ccc21

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 15/20 0.39
PPARG P37231 2/20 0.34
PPARD Q03181 2/20 0.34
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL1708035 0.92 FFAR1 (0.44) FFAR1PPARGPPARD
SCHEMBL10012713 0.91 FFAR1 (0.43) FFAR1PPARGPPARD
SCHEMBL10291337 0.90 TSHR (0.39) FFAR1PPARGPPARDLMNAPOLB
SCHEMBL1708109 0.87 FFAR1 (0.37) FFAR1PPARGPPARDLMNAGAA
SCHEMBL1708095 0.87 SMN1; SMN2 (0.39) FFAR1PPARGPPARDLMNAGAA
SCHEMBL1708082 0.86 FFAR1 (0.36) FFAR1PPARDLMNA
SCHEMBL1708140 0.86 FFAR1 (0.38) FFAR1PPARGPPARDPOLBGAA
SCHEMBL1708153 0.86 SMN1; SMN2 (0.40) FFAR1PPARDLMNA
SCHEMBL1708036 0.85 INSR (0.35) FFAR1LMNAGAA
SCHEMBL1708164 0.84 FFAR1 (0.37) FFAR1PPARGPPARDLMNAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-07-05 US disclosed
EP-2440541-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF Takeda Pharmaceutical Company Limited (JP) 2012-04-18 EP disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 WO disclosed
WO-2010143733-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-12-16 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-20120172351-A1 NOVEL FUSED CYCLIC COMPOUND AND USE THEREOF GPR119, INSR, GLP1R FFAR1 20/4885PPARG 155/4885PPARD 133/4885

“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.