SCHEMBL4259540

SCHEMBL4259540

Cc1cc(-c2cccc(C#N)c2)cc2c1OCC(=O)N2

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PGR P06401 11/20 0.45
NR3C2 P08235 3/20 0.45
NR3C1 P04150 2/20 0.45
CHEK1 O14757 1/20 0.44
CREBBP Q92793 1/20 0.44
MAP4K4 O95819 1/20 0.42
GSK3A P49840 1/20 0.42
AR P10275 1/20 0.40
RAF1 P04049 1/20 0.40
BRAF P15056 1/20 0.40

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
SCHEMBL4261964 0.86 PGR (0.50) PGRNR3C2NR3C1
SCHEMBL4263576 0.84 NR3C2 (0.50) PGRNR3C2NR3C1RAF1BRAF
SCHEMBL4267401 0.83 PGR (0.49) PGRNR3C2NR3C1
SCHEMBL4260391 0.81 PGR (0.48) PGRNR3C2NR3C1AR
SCHEMBL8201909 0.81 PGR (0.42) PGRNR3C2NR3C1RAF1BRAF
SCHEMBL4269390 0.80 NR3C2 (0.52) PGRNR3C2NR3C1CHEK1RAF1
SCHEMBL4260635 0.80 NR3C2 (0.46) PGRNR3C2NR3C1AR
SCHEMBL4266179 0.79 NR3C2 (0.45) PGRNR3C2NR3C1CHEK1RAF1
SCHEMBL4266646 0.76 PGR (0.60) PGRNR3C2NR3C1
SCHEMBL4262026 0.76 NR3C2 (0.46) PGRNR3C2NR3C1AR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090054417-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS IRM LLC (BM) 2009-02-26 US claimed
CN-101365696-A Compounds and compositions as modulators of steroid hormone nuclear receptors IRM LLC (BM) 2009-02-11 CN claimed
US-20090054417-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS IRM LLC (BM) 2009-02-26 US disclosed
US-20090054417-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS IRM LLC (BM) 2009-02-26 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-20090054417-A1 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS NR5A1, ESRRA, NR3C1 PGR 46/4885NR3C2 7/4885NR3C1 3/4885

“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.