SCHEMBL1363891

SCHEMBL1363891

CC(C)n1cc2cc(C(c3ccccc3)C(C)(C)C(=O)Nc3nncs3)ccc2n1

nearest known ligand 0.67

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.67
PGR P06401 4/20 0.62
AR P10275 1/20 0.61

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
SCHEMBL12140273 0.86 NR3C1 (0.71) NR3C1PGRAR
SCHEMBL1362646 0.85 NR3C1 (0.69) NR3C1PGRAR
SCHEMBL1361019 0.85 NR3C1 (0.69) NR3C1PGRAR
SCHEMBL14218398 0.83 NR3C1 (0.61) NR3C1PGRAR
SCHEMBL1362093 0.83 NR3C1 (0.66) NR3C1PGRAR
SCHEMBL1361043 0.82 NR3C1 (0.60) NR3C1PGRAR
SCHEMBL1361118 0.80 NR3C1 (1.00) NR3C1PGR
SCHEMBL12592979 0.80 NR3C1 (0.81) NR3C1PGRAR
SCHEMBL2896420 0.78 NR3C1 (1.00) NR3C1PGRAR
SCHEMBL2898731 0.78 NR3C1 (0.83) NR3C1PGRAR

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-8067447-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-11-29 US disclosed
US-20100076014-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2010-03-25 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-20100076014-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF NFRKB, NFKBIA, NFKB1 NR3C1 11/4885PGR 2161/4885AR 110/4885

“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.