SCHEMBL4289231

SCHEMBL4289231

CON(C)C(=O)c1cc(Br)c2c(c1)NC(=O)CO2

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.36
MAPT P10636 5/20 0.36
POLB P06746 2/20 0.36
PDE3B Q13370 2/20 0.36
PDE3A Q14432 2/20 0.36
NR3C2 P08235 1/20 0.35
PKM P14618 1/20 0.34
LMNA P02545 2/20 0.34
RXFP1 Q9HBX9 1/20 0.34
USP2 O75604 1/20 0.34
DNMT1 P26358 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
GAA P10253 2/20 0.34
MMP12 P39900 1/20 0.33

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
SCHEMBL28998391 0.82 ALDH1A1 (0.44) ALDH1A1MAPTPOLBPDE3BPDE3A
SCHEMBL4290971 0.80 ALDH1A1 (0.41) ALDH1A1MAPTPOLBPDE3BPDE3A
SCHEMBL4286907 0.79 GAA (0.44) ALDH1A1MAPTPDE3BPDE3ANR3C2
SCHEMBL4291156 0.78 ALDH1A1 (0.44) ALDH1A1MAPTPDE3BPDE3ANR3C2
SCHEMBL4290010 0.77 TSHR (0.41) ALDH1A1MAPTPDE3BPDE3ANR3C2
SCHEMBL4673975 0.74 PKM (0.43) ALDH1A1MAPTPOLBPDE3BPDE3A
SCHEMBL31480872 0.73 KMT2A (0.36) ALDH1A1MAPTPKMLMNAL3MBTL1
SCHEMBL10222933 0.72 SMYD3 (0.49) ALDH1A1POLBGAAMMP12
SCHEMBL17875671 0.71 PDE3B (0.43) ALDH1A1MAPTPDE3BPDE3ANR3C2
SCHEMBL4296049 0.70 ALDH1A1 (0.40) ALDH1A1MAPTPKMRXFP1USP2

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 ALDH1A1 2708/4885MAPT 4442/4885POLB 4858/4885

“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.