SCHEMBL8259299

SCHEMBL8259299

CCCC1=C(C(=O)OC)C(c2ccc(Cl)cc2Cl)C(C#N)=C(C)N1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 3/20 0.51
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.43
HPGD P15428 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HSD17B10 Q99714 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
MAPK1 P28482 1/20 0.42
LMNA P02545 1/20 0.41
CACNA1B Q00975 1/20 0.41
APBA1 Q02410 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL13587735 0.92 NR3C2 (0.60) NR3C2MAPK1
SCHEMBL294084 0.91 NR3C2 (0.50) NR3C2ALDH1A1KDM4EGAAHPGD
SCHEMBL8258895 0.89 NR3C2 (0.52) NR3C2ALDH1A1KDM4EGAAHPGD
SCHEMBL8257066 0.89 NR3C2 (0.46) NR3C2KMT2A
SCHEMBL295535 0.88 NR3C2 (0.48) NR3C2ALDH1A1KDM4EGAAHPGD
SCHEMBL13587783 0.86 NR3C2 (0.48) NR3C2
SCHEMBL8258493 0.84 MAPK1 (0.53) NR3C2MAPK1
SCHEMBL8257348 0.82 NR3C2 (0.49) NR3C2ALDH1A1KDM4EGAAHPGD
SCHEMBL8252931 0.82 NR3C2 (0.50) NR3C2ALDH1A1KDM4EGAAHPGD
SCHEMBL8252939 0.82 NR3C2 (0.63) NR3C2KDM4EGAA

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-20090298872-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROIDAL RECEPTORS AND CALCIUM CHANNEL ACTIVITIES IRM LLC (BM) 2009-12-03 US disclosed
WO-2006066011-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROIDAL RECEPTORS AND CALCIUM CHANNEL ACTIVITIES IRM LLC (BM) 2006-06-22 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-20090298872-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROIDAL RECEPTORS AND CALCIUM CHANNEL ACTIVITIES TRPV1, TRPV2, TRPV6 NR3C2 12/4885ALDH1A1 3716/4885KDM4E 3960/4885

“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.