SCHEMBL4287057

SCHEMBL4287057

O=C1COc2ccc(C(=O)Cc3ccc(Cl)cc3)cc2N1

nearest known ligand 0.78

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.78
KDM4E B2RXH2 1/20 0.78
MAPT P10636 4/20 0.69
MEN1 O00255 1/20 0.59
KMT2A Q03164 1/20 0.59
CASP3 P42574 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
PKM P14618 3/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
RXFP1 Q9HBX9 1/20 0.54
TSHR P16473 1/20 0.54
DRD4 P21917 1/20 0.54
PARP1 P09874 1/20 0.53
GAA P10253 1/20 0.52

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
SCHEMBL4290782 0.88 ALDH1A1 (0.65) ALDH1A1KDM4EMAPTPKML3MBTL1
SCHEMBL4288577 0.88 ALDH1A1 (0.65) ALDH1A1KDM4EMAPTCASP3SENP7
SCHEMBL4293605 0.88 ALDH1A1 (0.68) ALDH1A1KDM4EMAPTCASP3SENP7
SCHEMBL4296783 0.87 ALDH1A1 (0.65) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4295502 0.84 MAPT (0.72) ALDH1A1KDM4EMAPTPKML3MBTL1
SCHEMBL4724780 0.83 ALDH1A1 (0.62) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL532500 0.82 ALDH1A1 (1.00) ALDH1A1KDM4EMAPTCASP3SENP7
SCHEMBL29550875 0.82 ALDH1A1 (1.00) ALDH1A1KDM4EMAPTCASP3SENP7
SCHEMBL4287139 0.81 ALDH1A1 (0.66) ALDH1A1KDM4EMAPTMEN1KMT2A
SCHEMBL4294572 0.80 ALDH1A1 (0.61) ALDH1A1KDM4EMAPTCASP3SENP7

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 6 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
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
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 2708/4885KDM4E 3035/4885MAPT 4442/4885

“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.