SCHEMBL4287079

SCHEMBL4287079

CNC(=O)c1ccc2c(c1)SC(c1ccccc1)C(c1ccc3c(c1)NC(=O)CO3)=C2

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.52
NR3C1 P04150 4/20 0.52
AR P10275 3/20 0.52
PGR P06401 2/20 0.52
GAA P10253 2/20 0.44
SMYD3 Q9H7B4 1/20 0.41
ALDH1A1 P00352 5/20 0.40
LMNA P02545 2/20 0.40
KMT2A Q03164 1/20 0.40
MAPT P10636 3/20 0.40
POLB P06746 1/20 0.40
MAOA P21397 1/20 0.39
HTT P42858 1/20 0.39
PKM P14618 1/20 0.39

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
SCHEMBL4288212 0.91 NR3C2 (0.56) NR3C2NR3C1ARPGRGAA
SCHEMBL4295632 0.90 NR3C2 (0.52) NR3C2NR3C1ARPGRGAA
SCHEMBL4291552 0.89 NR3C2 (0.54) NR3C2NR3C1ARPGRGAA
SCHEMBL4289009 0.88 NR3C2 (0.52) NR3C2NR3C1ARPGRGAA
SCHEMBL4293620 0.85 NR3C2 (0.58) NR3C2NR3C1ARPGRGAA
SCHEMBL4286517 0.84 NR3C2 (0.66) NR3C2NR3C1ARPGRALDH1A1
SCHEMBL4291099 0.84 NR3C2 (0.66) NR3C2NR3C1ARPGRALDH1A1
SCHEMBL4293587 0.83 NR3C2 (0.58) NR3C2NR3C1ARPGRALDH1A1
SCHEMBL4286739 0.83 NR3C2 (0.54) NR3C2NR3C1ARPGRALDH1A1
SCHEMBL13662395 0.82 NR3C2 (0.56) NR3C2NR3C1ARPGRALDH1A1

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 2 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
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 1/4885NR3C1 2/4885AR 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.