SCHEMBL4286827

SCHEMBL4286827

O=CC(=Cc1ccccc1)c1cc(F)c2c(c1)NC(=O)CO2

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
LMNA P02545 1/20 0.44
NR3C2 P08235 5/20 0.43
GAA P10253 1/20 0.38
NR3C1 P04150 2/20 0.38
PGR P06401 2/20 0.38
MAPT P10636 3/20 0.37
PKM P14618 1/20 0.37
ADRB2 P07550 3/20 0.36
KDM4E B2RXH2 1/20 0.36
PARP1 P09874 2/20 0.35
HTR1A P08908 2/20 0.35
HTR1D P28221 1/20 0.35
HTR1B P28222 1/20 0.35
SLC6A4 P31645 1/20 0.35
DRD2 P14416 1/20 0.34
HTR2A P28223 1/20 0.34

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
SCHEMBL8239799 1.00 ALDH1A1 (0.44) ALDH1A1LMNANR3C2GAANR3C1
SCHEMBL4286826 1.00 ALDH1A1 (0.44) ALDH1A1LMNANR3C2GAANR3C1
SCHEMBL13662310 0.91 NR3C2 (0.44) ALDH1A1NR3C2NR3C1PGRMAPT
SCHEMBL4293841 0.91 NR3C2 (0.44) ALDH1A1NR3C2NR3C1PGRMAPT
SCHEMBL4293845 0.91 NR3C2 (0.44) ALDH1A1NR3C2NR3C1PGRMAPT
SCHEMBL4288423 0.86 ALDH1A1 (0.44) ALDH1A1LMNANR3C2GAANR3C1
SCHEMBL8238482 0.86 ALDH1A1 (0.44) ALDH1A1LMNANR3C2GAANR3C1
SCHEMBL4288418 0.86 ALDH1A1 (0.44) ALDH1A1LMNANR3C2GAANR3C1
SCHEMBL4290862 0.81 NR3C2 (0.45) ALDH1A1NR3C2NR3C1PGRMAPT
SCHEMBL4290858 0.81 NR3C2 (0.45) ALDH1A1NR3C2NR3C1PGRMAPT

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 ALDH1A1 2708/4885LMNA 2152/4885NR3C2 1/4885

“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.