SCHEMBL4290937

SCHEMBL4290937

Cc1nn(C(C)C)c(-c2ccc3c(c2)NC(=O)CO3)c1I

nearest known ligand 0.53

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 17/20 0.53
PGR P06401 10/20 0.53
AR P10275 4/20 0.52
MMP12 P39900 1/20 0.48
NR3C1 P04150 1/20 0.48
KDM4E B2RXH2 2/20 0.47
RAB9A P51151 2/20 0.47
NPC1 O15118 1/20 0.47
ALDH1A1 P00352 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
SCHEMBL4291262 0.83 NR3C2 (0.70) NR3C2PGRAR
SCHEMBL4287089 0.83 NR3C2 (0.68) NR3C2PGRAR
SCHEMBL3488984 0.81 NR3C2 (0.76) NR3C2PGRAR
SCHEMBL4299978 0.79 NR3C2 (0.60) NR3C2PGRAR
SCHEMBL4295560 0.79 NR3C2 (0.66) NR3C2PGRARMMP12NR3C1
SCHEMBL4286898 0.76 NR3C2 (0.67) NR3C2PGRARMMP12NR3C1
SCHEMBL4296087 0.72 NR3C2 (0.77) NR3C2PGRARMMP12KDM4E
SCHEMBL4297101 0.72 NR3C2 (0.76) NR3C2PGRAR
SCHEMBL4298131 0.71 NR3C2 (0.92) NR3C2PGRAR
SCHEMBL4302163 0.71 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 408/4885AR 60/4885

“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.