SCHEMBL2901237

SCHEMBL2901237

CC(C)(C(=O)Nc1nc(-c2cccc3ccccc23)cs1)C(c1ccccc1)c1cccc(O)c1

nearest known ligand 0.56

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.49
MEN1 O00255 2/20 0.48
MAPT P10636 2/20 0.48
KMT2A Q03164 2/20 0.48
NR3C1 P04150 16/20 0.48
PGR P06401 5/20 0.48
AR P10275 4/20 0.48

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
SCHEMBL2899056 0.93 MEN1 (0.54) TYRMEN1MAPTKMT2ANR3C1
SCHEMBL2900712 0.92 NR3C1 (0.58) TYRMEN1MAPTKMT2ANR3C1
SCHEMBL2892648 0.91 TYR (0.53) TYRMEN1MAPTKMT2ANR3C1
SCHEMBL2899345 0.90 NR3C1 (0.54) TYRMEN1MAPTKMT2ANR3C1
SCHEMBL2898765 0.88 NR3C1 (0.51) MEN1MAPTKMT2ANR3C1
SCHEMBL2898015 0.87 ABL1 (0.56) MEN1MAPTKMT2ANR3C1PGR
SCHEMBL2901404 0.86 NR3C1 (0.60) MEN1MAPTKMT2ANR3C1PGR
SCHEMBL2901719 0.86 MEN1 (0.48) MEN1MAPTKMT2ANR3C1PGR
SCHEMBL2901142 0.85 MEN1 (0.51) MEN1MAPTKMT2ANR3C1PGR
SCHEMBL12592719 0.85 RAB9A (0.56) MEN1MAPTKMT2ANR3C1PGR

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-7968577-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-06-28 US disclosed
US-7968577-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-06-28 US disclosed
US-7968577-B2 Modulators of glucocorticoid receptor, AP-1, and/or NF-κB activity and use thereof BRISTOL-MYERS SQUIBB COMPANY (US) 2011-06-28 US disclosed
US-20100063051-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2010-03-11 US disclosed
US-20100063051-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2010-03-11 US disclosed
US-20100063051-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF BRISTOL-MYERS SQUIBB COMPANY 2010-03-11 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-20100063051-A1 MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kB ACTIVITY AND USE THEREOF NFRKB, NFKB2, NFKBIA TYR 2189/4885MEN1 3339/4885MAPT 1222/4885

“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.