SCHEMBL4299788

SCHEMBL4299788

Cc1cc(C(=O)CC(=O)C(C)(F)F)cc2c1OCC(=O)N2

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 4/20 0.42
MAPT P10636 2/20 0.41
ADRB2 P07550 10/20 0.39
ADRB1 P08588 9/20 0.39
ALDH1A1 P00352 1/20 0.39
PGR P06401 3/20 0.39
NR3C1 P04150 2/20 0.39
GAA P10253 1/20 0.37
POLB P06746 1/20 0.37

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
SCHEMBL4295975 0.92 NR3C2 (0.43) NR3C2MAPTADRB2ADRB1ALDH1A1
SCHEMBL4287097 0.79 ALDH1A1 (0.43) NR3C2MAPTADRB2ADRB1ALDH1A1
SCHEMBL4287760 0.79 ALDH1A1 (0.41) NR3C2MAPTADRB2ADRB1ALDH1A1
SCHEMBL4296049 0.78 ALDH1A1 (0.40) MAPTADRB2ADRB1ALDH1A1GAA
SCHEMBL4297388 0.77 LMNA (0.45) MAPTADRB2ADRB1ALDH1A1GAA
SCHEMBL4291222 0.77 NR3C2 (0.50) NR3C2MAPTALDH1A1PGRNR3C1
SCHEMBL4286243 0.76 NR3C2 (0.48) NR3C2MAPTADRB2ADRB1ALDH1A1
SCHEMBL4764619 0.70 NR3C2 (0.43) NR3C2MAPTADRB2ADRB1ALDH1A1
SCHEMBL1730597 0.70 PTGS2 (0.42) MAPTADRB2ADRB1ALDH1A1
SCHEMBL4294026 0.70 ALDH1A1 (0.67) MAPTALDH1A1GAAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-08 US disclosed
EP-1971596-A2 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS Takeda Pharmaceutical Company Limited (JP) 2008-09-24 EP disclosed
WO-2007077961-A2 FUSED HETEROCYCLIC COMPOUNDS AND THEIR USE AS MINERALOCORTICOID RECEPTOR LIGANDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-07-12 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-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands NR3C2, NR3C1, MC2R NR3C2 1/4885MAPT 4442/4885ADRB2 23/4885

“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.