SCHEMBL4298670

SCHEMBL4298670

CCc1nn(C)c(-c2ccc3c(c2)NC(=O)CO3)c1Br

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 17/20 0.55
PGR P06401 9/20 0.55
PARP1 P09874 1/20 0.51
AR P10275 3/20 0.49
NR3C1 P04150 1/20 0.48
PDE3B Q13370 1/20 0.47
PDE3A Q14432 1/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL4286898 0.85 NR3C2 (0.67) NR3C2PGRARNR3C1PDE3B
SCHEMBL4293659 0.83 NR3C2 (0.70) NR3C2PGRARNR3C1
SCHEMBL4297075 0.82 NR3C2 (0.57) NR3C2PGRARNR3C1
SCHEMBL4291918 0.79 NR3C2 (0.69) NR3C2PGRPARP1ARNR3C1
SCHEMBL4291082 0.77 NR3C2 (0.67) NR3C2PGRPARP1NR3C1PDE3B
SCHEMBL4296087 0.75 NR3C2 (0.77) NR3C2PGRAR
SCHEMBL4297101 0.74 NR3C2 (0.76) NR3C2PGRAR
SCHEMBL4302163 0.73 NR3C2 (0.74) NR3C2PGRAR
SCHEMBL4298131 0.73 NR3C2 (0.92) NR3C2PGRAR
SCHEMBL4290608 0.73 NR3C2 (0.74) NR3C2PGRAR

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-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-10-08 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-20090253687-A1 Fused Heterocyclic Compounds and Their Use as Mineralocorticoid Receptor Ligands NR3C2, NR3C1, MC2R NR3C2 1/4885PGR 408/4885PARP1 4875/4885

“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.