SCHEMBL282196

SCHEMBL282196

Cc1cc(O[Si](C(C)C)(C(C)C)C(C)C)cc(C)c1Br

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
LMNA P02545 2/20 0.40
HPGD P15428 1/20 0.38
MAPT P10636 1/20 0.33
STAT3 P40763 1/20 0.33
NOD2 Q9HC29 1/20 0.33
TSHR P16473 1/20 0.32

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
SCHEMBL18428478 0.79 ALDH1A1 (0.33) ALDH1A1
SCHEMBL282712 0.79 ALDH1A1 (0.41) ALDH1A1TSHR
SCHEMBL15154024 0.79 TSHR (0.32) TSHR
SCHEMBL17205115 0.79 HAO1 (0.44) ALDH1A1LMNAMAPTSTAT3TSHR
SCHEMBL3937179 0.78 GABRA1 (0.32)
SCHEMBL18471986 0.76 ALDH1A1 (0.33) ALDH1A1TSHR
SCHEMBL17557208 0.75 MAPT (0.41) ALDH1A1HPGDMAPT
SCHEMBL4208648 0.75 TP53 (0.35)
SCHEMBL2411427 0.75 CYP3A4 (0.42) ALDH1A1LMNAHPGDMAPTTSHR
SCHEMBL282124 0.75 AKR1B1 (0.32) ALDH1A1LMNAHPGDMAPT

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1689383-B1 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS INC (US) 2012-10-31 EP disclosed
EP-2428516-A1 Novel phosphorus-containing thyromimetics Metabasis Therapeutics, Inc. (US) 2012-03-14 EP disclosed
US-20110218225-A1 NON-STEROIDAL LIGANDS FOR THE GLUCOCORTICOID RECEPTOR, COMPOSITIONS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-09-08 US disclosed
US-7947726-B2 Non-steroidal ligands for the glucocorticoid receptor, and compositions thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2011-05-24 US disclosed
US-7829552-B2 Phosphorus-containing thyromimetics METABASIS THERAPEUTICS, INC. (US) 2010-11-09 US disclosed
US-20100081634-A1 Novel Phosphorus-Containing Thyromimetics METABASIS THERAPEUTICS, INC. (US) 2010-04-01 US disclosed
US-20090137655-A1 Non-Steroidal Ligands for the Glucocorticoid Receptor, Compositions and Uses Thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2009-05-28 US disclosed
US-20090118236-A1 Novel Phosphorus-Containing Thyromimetics CITIBANK, N.A., AS ADMINISTRATIVE AGENT 2009-05-07 US disclosed
US-7514419-B2 Phosphorus-containing thyromimetics METABASIS THERAPEUTICS, INC. (US) 2009-04-07 US disclosed
EP-1689383-A4 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS INC (US) 2009-02-18 EP disclosed
WO-2005051298-A2 NOVEL PHOSPHORUS-CONTAINING THYROMIMETICS METABASIS THERAPEUTICS, INC. (US) 2005-06-09 WO disclosed
US-20050054700-A1 Non-steroidal ligands for the glucocorticoid receptor, compositions and uses thereof THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2005-03-10 US disclosed
US-6831093-B2 For selectively modulating the activation, repression, agonism and antagonism effects of the glucocorticoid receptor in a patient; for therapy and prophylaxis of obesity, diabetes, depression, neurodegeneration or an inflammatory disease THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-12-14 US disclosed
EP-1467730-A1 NON-STEROIDAL LIGANDS FOR THE GLUCOCORTICOID RECEPTOR, COMPOSITIONS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2004-10-20 EP disclosed
US-6777442-B2 Diphenyl derivatives BAYER AKTIENGESELLSCHAFT (DE) 2004-08-17 US disclosed
EP-1370523-A1 DIPHENYL DERIVATIVES Bayer Aktiengesellschaft (DE) 2003-12-17 EP disclosed
US-20030176478-A1 Non-steroidal ligands for the glucocorticoid receptor, compositions and uses thereof NIH-DEITR 2003-09-18 US disclosed
WO-2003061651-A1 NON-STEROIDAL LIGANDS FOR THE GLUCOCORTICOID RECEPTOR, COMPOSITIONS AND USES THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2003-07-31 WO disclosed
US-20030105078-A1 Diphenyl derivatives BAYER AKTIENGESSELLSCHAFT (DE) 2003-06-05 US disclosed
WO-2002072539-A1 DIPHENYL DERIVATIVES BAYER AKTIENGESELLSCHAFT (DE) 2002-09-19 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 (7 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-20050054700-A1 Non-steroidal ligands for the glucocorticoid receptor, compositions and uses thereof NR3C1, NR3C2, GCGR ALDH1A1 3489/4885LMNA 3108/4885HPGD 836/4885
US-20100081634-A1 Novel Phosphorus-Containing Thyromimetics PYGL, THRA, THOP1 ALDH1A1 4227/4885LMNA 3568/4885HPGD 1338/4885
US-20090118236-A1 Novel Phosphorus-Containing Thyromimetics THRA, PYGL, THRB ALDH1A1 4038/4885LMNA 4127/4885HPGD 1761/4885
US-20110218225-A1 NON-STEROIDAL LIGANDS FOR THE GLUCOCORTICOID RECEPTOR, COMPOSITIONS AND USES THEREOF NR3C1, NR3C2, GCGR ALDH1A1 3489/4885LMNA 3108/4885HPGD 836/4885
US-20030176478-A1 Non-steroidal ligands for the glucocorticoid receptor, compositions and uses thereof NR3C1, NR3C2, GCGR ALDH1A1 3489/4885LMNA 3108/4885HPGD 836/4885
US-20090137655-A1 Non-Steroidal Ligands for the Glucocorticoid Receptor, Compositions and Uses Thereof NR3C1, NR3C2, GCGR ALDH1A1 3489/4885LMNA 3108/4885HPGD 836/4885
US-20030105078-A1 Diphenyl derivatives DPP4, DPP3, DPM1 ALDH1A1 922/4885LMNA 1567/4885HPGD 526/4885

“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.