SCHEMBL1094081

SCHEMBL1094081

CC(C)[Si](OC1CCN(C(c2ccc(-c3ccc(C(=O)O)cc3)cc2Cl)C2CCNC2=O)CC1)(C(C)C)C(C)C

nearest known ligand 0.33

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.33
PDE4B Q07343 2/20 0.33
PDE4C Q08493 2/20 0.33
PDE4D Q08499 2/20 0.33
ADRB3 P13945 2/20 0.31
ADRB1 P08588 1/20 0.31
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
PSD A5PKW4 1/20 0.30
PRKAB2 O43741 1/20 0.30
PRKAG1 P54619 1/20 0.30
PRKAA2 P54646 1/20 0.30
PRKAA1 Q13131 1/20 0.30
PRKAG3 Q9UGI9 1/20 0.30
PRKAG2 Q9UGJ0 1/20 0.30
PRKAB1 Q9Y478 1/20 0.30

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
SCHEMBL1092228 1.00 PDE4A (0.33) PDE4APDE4BPDE4CPDE4DADRB3
SCHEMBL1093033 0.92 PSD (0.34) PSD
SCHEMBL1092157 0.91 PDE4D (0.32) PDE4APDE4BPDE4CPDE4DRXRA
SCHEMBL4191602 0.85 XDH (0.35) ADRB3ADRB1PRKAB2PRKAG1PRKAA2
SCHEMBL1092147 0.83 PSD (0.35) PSD
SCHEMBL208541 0.80 SRD5A2 (0.32) PDE4APDE4BPDE4CPDE4DADRB3
SCHEMBL4060990 0.80 SRD5A2 (0.32) PDE4APDE4BPDE4CPDE4DADRB3
SCHEMBL1092618 0.79 CHRM1 (0.33)
SCHEMBL209090 0.77 XDH (0.33) ADRB3ADRB1PRKAB2PRKAG1PRKAA2
SCHEMBL4197218 0.76 CHEK2 (0.36)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8153807-B2 Inhibitors of 11-beta-hydroxysteroid dehydrogenase 1 ELI LILLY AND COMPANY (US) 2012-04-10 US disclosed
EP-2021336-B1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 LILLY CO ELI (US) 2010-06-30 EP disclosed
US-20090111809-A1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 BUSH JULIE KAY 2009-04-30 US disclosed
EP-2021336-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2009-02-11 EP disclosed
WO-2007127688-A2 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 ELI LILLY AND COMPANY (US) 2007-11-08 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 (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-20090111809-A1 INHIBITORS OF 11-BETA-HYDROXYSTEROID DEHYDROGENASE 1 HSD11B1, HSD3B1, HSD11B2 PDE4A 713/4885PDE4B 882/4885PDE4C 1144/4885

“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.