SCHEMBL1247083

SCHEMBL1247083

CC(C)(C)[Si](C)(C)OCCCCc1cccc(CO)c1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 3/20 0.37
CYP4A11 Q02928 3/20 0.37
DUT P33316 1/20 0.36
PPARG P37231 3/20 0.36
PPARA Q07869 3/20 0.36
LPL P06858 2/20 0.34
LIPG Q9Y5X9 2/20 0.34
DAO P14920 1/20 0.34
PRKCI P41743 1/20 0.33
S1PR1 P21453 1/20 0.33
CYP11B1 P15538 1/20 0.33
CYP11B2 P19099 1/20 0.33
ENPP2 Q13822 1/20 0.33

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
SCHEMBL21068770 0.96 DUT (0.37) CYP4F2CYP4A11DUTPPARGPPARA
SCHEMBL1627498 0.91 CYP4F2 (0.40) CYP4F2CYP4A11DUTPPARGPPARA
SCHEMBL1627173 0.85 DUT (0.40) CYP4F2CYP4A11DUTPPARGPPARA
SCHEMBL9321652 0.85 DUT (0.34) DUTS1PR1
SCHEMBL5280684 0.83 MAOB (0.44) DUT
SCHEMBL17398452 0.82 IDO1 (0.47) DUT
SCHEMBL3168839 0.81 GABRA1 (0.47) CYP4F2CYP4A11
SCHEMBL28266847 0.81 CYP4F2 (0.42) CYP4F2CYP4A11DUTPPARA
SCHEMBL3412299 0.81 ALDH1A1 (0.43) CYP4F2CYP4A11PPARGPPARA
SCHEMBL16307320 0.80 IDO1 (0.46)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8476265-B2 Compounds-801 ASTRAZENECA AB (SE) 2013-07-02 US disclosed
US-8476265-B2 Compounds-801 ASTRAZENECA AB (SE) 2013-07-02 US disclosed
US-8476265-B2 Compounds-801 ASTRAZENECA AB (SE) 2013-07-02 US disclosed
US-8455483-B2 Compounds—801 ASTRAZENECA AB (SE) 2013-06-04 US disclosed
US-8455483-B2 Compounds—801 ASTRAZENECA AB (SE) 2013-06-04 US disclosed
US-8455483-B2 Compounds—801 ASTRAZENECA AB (SE) 2013-06-04 US disclosed
US-20130018037-A1 Compounds - 801 ASTRAZENECA UK LIMITED (GB) 2013-01-17 US disclosed
US-20130018037-A1 Compounds - 801 ASTRAZENECA UK LIMITED (GB) 2013-01-17 US disclosed
EP-2459572-A2 SPIROCYCLIC AMIDE DERIVATIVES AstraZeneca AB (SE) 2012-06-06 EP disclosed
US-20110053909-A1 Compounds - 801 PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2011-03-03 US disclosed
US-20110053909-A1 Compounds - 801 PULMAGEN THERAPEUTICS (SYNERGY) LIMITED (GB) 2011-03-03 US disclosed
WO-2011012896-A2 COMPOUNDS - 801 ASTRAZENECA AB (SE) 2011-02-03 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 (2 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-20130018037-A1 Compounds - 801 ADRA2C, ADRB2, ADRB1 CYP4F2 874/4885CYP4A11 252/4885DUT 2957/4885
US-20110053909-A1 Compounds - 801 ADRA2C, ADRB2, ADRB1 CYP4F2 874/4885CYP4A11 252/4885DUT 2957/4885

“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.