SCHEMBL4864449

SCHEMBL4864449

COc1cc(OC)c(NC(=O)c2ccc(Oc3cc([Si](C)(C)C)ccc3Cl)o2)c(OC)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR4 O95977 8/20 0.46
S1PR2 O95136 4/20 0.46
S1PR3 Q99500 3/20 0.46
FPR1 P21462 1/20 0.44
GNRHR P30968 1/20 0.44
GPR183 P32249 1/20 0.44
GPR119 Q8TDV5 1/20 0.44
HTR1A P08908 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CNR1 P21554 1/20 0.42
DRD1 P21728 1/20 0.42
HTR2A P28223 1/20 0.42
ADORA2A P29274 1/20 0.42
OPRM1 P35372 1/20 0.42
SCN5A Q14524 1/20 0.42
SCN9A Q15858 1/20 0.42
SCN2A Q99250 1/20 0.42
SCN3A Q9NY46 1/20 0.42
SCN10A Q9Y5Y9 1/20 0.42
S1PR5 Q9H228 2/20 0.41

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
SCHEMBL4863093 0.91 S1PR4 (0.57) S1PR4S1PR2S1PR3HTR1AADORA3
SCHEMBL4858943 0.91 FPR1 (0.46) S1PR4S1PR2S1PR3FPR1GNRHR
SCHEMBL4862095 0.89 GNRHR (0.48) S1PR4S1PR2S1PR3FPR1GNRHR
SCHEMBL4862543 0.88 FPR1 (0.44) S1PR4S1PR2S1PR3FPR1GNRHR
SCHEMBL4863755 0.87 GNRHR (0.48) S1PR4S1PR2S1PR3FPR1GNRHR
SCHEMBL4863372 0.84 S1PR4 (0.40) S1PR4S1PR2S1PR3GNRHRHTR1A
SCHEMBL4852317 0.83 GNRHR (0.42) S1PR4S1PR2S1PR3GNRHRHTR1A
SCHEMBL4858495 0.81 S1PR4 (0.49) S1PR4S1PR2S1PR3S1PR5S1PR1
SCHEMBL6679959 0.81 ALDH1A1 (0.60) S1PR4S1PR2S1PR3FPR1GNRHR
SCHEMBL4863039 0.80 GNRHR (0.50) S1PR4S1PR2S1PR3FPR1GNRHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7407649-B2 Compounds having a benzene ring substituted with 1 or 2 trialkylsilyl(alkyl) groups and at least 2 additional aryl or heteroaryl rings: 5-[2-methyl-5-(trimethylsilyl)phenoxy]-N-(2,6-dimethoxyphenyl)furan-2-carboxamide; Gonadotropin-Releasing Hormone antagonists; anticancer agents PARADIGM THERAPEUTICS LTD (GB) 2008-08-05 US claimed
EP-1644385-B1 SILICON COMPOUNDS AND THEIR USE TAKEDA CAMBRIDGE LTD (GB) 2007-08-29 EP claimed
US-20070110708-A1 Silicon compounds and their use PARADIGM THERAPEUTICS LTD (GB) 2007-05-17 US claimed
US-7407649-B2 Compounds having a benzene ring substituted with 1 or 2 trialkylsilyl(alkyl) groups and at least 2 additional aryl or heteroaryl rings: 5-[2-methyl-5-(trimethylsilyl)phenoxy]-N-(2,6-dimethoxyphenyl)furan-2-carboxamide; Gonadotropin-Releasing Hormone antagonists; anticancer agents PARADIGM THERAPEUTICS LTD (GB) 2008-08-05 US disclosed
US-7407649-B2 Compounds having a benzene ring substituted with 1 or 2 trialkylsilyl(alkyl) groups and at least 2 additional aryl or heteroaryl rings: 5-[2-methyl-5-(trimethylsilyl)phenoxy]-N-(2,6-dimethoxyphenyl)furan-2-carboxamide; Gonadotropin-Releasing Hormone antagonists; anticancer agents PARADIGM THERAPEUTICS LTD (GB) 2008-08-05 US disclosed
EP-1644385-B1 SILICON COMPOUNDS AND THEIR USE TAKEDA CAMBRIDGE LTD (GB) 2007-08-29 EP disclosed
US-20070110708-A1 Silicon compounds and their use PARADIGM THERAPEUTICS LTD (GB) 2007-05-17 US disclosed
US-20070110708-A1 Silicon compounds and their use PARADIGM THERAPEUTICS LTD (GB) 2007-05-17 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-20070110708-A1 Silicon compounds and their use SOST, SMAD3, SMAD2 S1PR4 1001/4885S1PR2 534/4885S1PR3 959/4885

“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.