SCHEMBL4861352

SCHEMBL4861352

COc1nc(Cl)nc(OC)c1NC(=O)c1ccc(Oc2cc([Si](C)(C)C)ccc2Br)o1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 2/20 0.39
DRD1 P21728 2/20 0.39
HTR2A P28223 2/20 0.39
OPRM1 P35372 2/20 0.39
GNRHR P30968 2/20 0.39
CACNA1F O60840 1/20 0.39
CHRM4 P08173 1/20 0.39
CHRM1 P11229 1/20 0.39
CYP2C9 P11712 1/20 0.39
DRD4 P21917 1/20 0.39
SLC6A2 P23975 1/20 0.39
HRH2 P25021 1/20 0.39
TACR1 P25103 1/20 0.39
PTAFR P25105 1/20 0.39
HTR2C P28335 1/20 0.39
AGTR1 P30556 1/20 0.39
SLC6A4 P31645 1/20 0.39
HTR7 P34969 1/20 0.39
DRD3 P35462 1/20 0.39
OPRK1 P41145 1/20 0.39

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
SCHEMBL4855023 0.91 GNRHR (0.39) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL4864354 0.90 GNRHR (0.42) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL6644161 0.87 CYP2C9 (0.38) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL4863834 0.84 S1PR4 (0.47) CYP2C9GAAMEN1KMT2ANPSR1
SCHEMBL4863372 0.83 S1PR4 (0.40) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL4862543 0.83 FPR1 (0.44) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL4855584 0.83 GNRHR (0.45) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL4852317 0.83 GNRHR (0.42) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL4857405 0.82 GNRHR (0.47) ADORA3DRD1HTR2AOPRM1GNRHR
SCHEMBL14086966 0.81 GNRHR (0.35) ADORA3DRD1HTR2AOPRM1GNRHR

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 ADORA3 4741/4885DRD1 3910/4885HTR2A 3170/4885

“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.