SCHEMBL4267779

SCHEMBL4267779

O=Cc1cccc(C=Cc2ccc3c(c2)NC(=O)CO3)c1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 5/20 0.59
ALDH1A1 P00352 5/20 0.53
LMNA P02545 1/20 0.53
MMP12 P39900 1/20 0.51
PARP1 P09874 3/20 0.48
MAPT P10636 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
KMT2A Q03164 2/20 0.46
NPSR1 Q6W5P4 1/20 0.46
PKM P14618 1/20 0.45
GAA P10253 1/20 0.43
TRPV1 Q8NER1 1/20 0.43

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
SCHEMBL13932054 1.00 NR3C2 (0.59) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL531838 0.90 MMP12 (0.61) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL4267374 0.87 ALDH1A1 (0.67) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL13932080 0.87 ALDH1A1 (0.67) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL13932083 0.85 MMP12 (0.65) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL4272473 0.85 MMP12 (0.65) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL27731422 0.85 NR3C2 (0.65) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL13932082 0.82 NR3C2 (0.58) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL4261472 0.82 NR3C2 (0.58) NR3C2ALDH1A1LMNAMMP12PARP1
SCHEMBL4263148 0.81 NR3C2 (0.54) NR3C2ALDH1A1LMNAMMP12MAPT

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-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
JP-2008508314-A 2008-03-21 JP claimed
EP-1778242-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS IRM LLC (BM) 2007-05-02 EP claimed
WO-2006015259-A2 COMPOUNDS AND COMPOSITIONS AS MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS IRM LLC (BM) 2006-02-09 WO claimed
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 NR3C2 7/4885ALDH1A1 3483/4885LMNA 1353/4885

“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.