SCHEMBL915319

SCHEMBL915319

CCCCCOC(=O)C1CCc2cc(F)ccc2O1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.56
CYP4A11 Q02928 1/20 0.56
PPARG P37231 5/20 0.42
PPARA Q07869 2/20 0.42
MLNR O43193 1/20 0.42
ADRB2 P07550 1/20 0.42
ADRB1 P08588 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD2 P14416 1/20 0.42
KCNE1 P15382 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
CNR1 P21554 1/20 0.42
SLC6A2 P23975 1/20 0.42
NPY1R P25929 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42

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
SCHEMBL19174157 0.87 CYP4F2 (0.72) CYP4F2CYP4A11PPARGPPARAMLNR
SCHEMBL6846728 0.87 CYP4F2 (0.72) CYP4F2CYP4A11PPARGPPARAMLNR
SCHEMBL14681244 0.87 CYP4F2 (0.72) CYP4F2CYP4A11PPARGPPARAMLNR
SCHEMBL29397407 0.87 CYP4F2 (0.72) CYP4F2CYP4A11PPARGPPARAMLNR
SCHEMBL908570 0.87 CYP4F2 (0.72) CYP4F2CYP4A11PPARGPPARAMLNR
SCHEMBL2426350 0.83 CYP4F2 (0.51) CYP4F2CYP4A11PPARGPPARACHRM1
SCHEMBL2005546 0.80 CYP4F2 (0.52) CYP4F2CYP4A11MLNRADRB2ADRB1
SCHEMBL13762677 0.80 CYP4F2 (0.52) CYP4F2CYP4A11MLNRADRB2ADRB1
SCHEMBL29601366 0.80 CYP4F2 (0.52) CYP4F2CYP4A11MLNRADRB2ADRB1
SCHEMBL7229977 0.80 CYP4F2 (0.52) CYP4F2CYP4A11MLNRADRB2ADRB1

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
EP-2265596-B1 PROCESS FOR PREPARING NEBIVOLOL ZACH SYSTEM SPA (IT) 2016-06-01 EP disclosed
US-8981127-B2 Method for preparing nebivolol ZACH SYSTEM (FR) 2015-03-17 US disclosed
US-8969597-B2 Process for preparing nebivolol ZACH SYSTEM S.P.A. (IT) 2015-03-03 US disclosed
EP-2456768-B1 PROCESS FOR PREPARING NEBIVOLOL ZACH SYSTEM SPA (IT) 2014-11-19 EP disclosed
EP-2456768-A1 PROCESS FOR PREPARING NEBIVOLOL ZaCh System S.p.A. (IT) 2012-05-30 EP disclosed
US-20120108826-A1 PROCESS FOR PREPARING NEBIVOLOL ZACH SYSTEM SPA (IT) 2012-05-03 US disclosed
US-8084629-B2 Process for preparing nebivolol ZACH SYSTEM S.P.A. (IT) 2011-12-27 US disclosed
US-20110237808-A1 METHOD FOR PREPARING NEBIVOLOL ZACH SYSTEM (FR) 2011-09-29 US disclosed
US-20110021793-A1 PROCESS FOR PREPARING NEBIVOLOL ZACH SYSTEM S.P.A. (IT) 2011-01-27 US disclosed
WO-2011009628-A1 PROCESS FOR PREPARING NEBIVOLOL ZACH SYSTEM SPA (IT) 2011-01-27 WO disclosed
EP-2265596-A2 PROCESS FOR PREPARING NEBIVOLOL ZaCh System S.p.A. (IT) 2010-12-29 EP disclosed
WO-2009121710-A2 PROCESS FOR PREPARING NEBIVOLOL ZACH SYSTEM S.P.A. (IT) 2009-10-08 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 (3 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-20110237808-A1 METHOD FOR PREPARING NEBIVOLOL ADRB1, ADRA1B, ADRB2 CYP4F2 160/4885CYP4A11 13/4885PPARG 2701/4885
US-20120108826-A1 PROCESS FOR PREPARING NEBIVOLOL ADRB1, ADRB2, ADRB3 CYP4F2 33/4885CYP4A11 6/4885PPARG 1228/4885
US-20110021793-A1 PROCESS FOR PREPARING NEBIVOLOL ADRB1, ADRA2B, ADRA1B CYP4F2 176/4885CYP4A11 12/4885PPARG 1318/4885

“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.