SCHEMBL2836050

SCHEMBL2836050

COC(C)(C)CCC(=O)/C(C)=C/C=C/C(C)=C/C=C/C(C)=C/C=C/C=C(C)/C=C/C=C(\C)CC/C=C(\C)CCC=C(C)C

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR1I2 O75469 1/20 0.56
LMNA P02545 1/20 0.56
PGR P06401 1/20 0.56
FNTA P49354 3/20 0.42
FNTB P49356 3/20 0.42
ALOX15 P16050 2/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 2/20 0.35
PTGS1 P23219 1/20 0.35
GGPS1 O95749 2/20 0.34

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
SCHEMBL5200105 1.00 NR1I2 (0.56) NR1I2LMNAPGRFNTAFNTB
SCHEMBL30555741 0.98 NR1I2 (0.58) NR1I2LMNAPGRFNTAFNTB
SCHEMBL2836272 0.89 NR1I2 (0.42) NR1I2LMNAPGRFNTAFNTB
SCHEMBL2835848 0.86 PTGS1 (0.46) NR1I2LMNAPGRALOX15ALDH1A1
SCHEMBL2832404 0.85 NR1I2 (0.62) NR1I2LMNAPGRFNTAFNTB
SCHEMBL2835821 0.85 NR1I2 (0.62) NR1I2LMNAPGRFNTAFNTB
SCHEMBL2838626 0.85 NR1I2 (0.62) NR1I2LMNAPGRFNTAFNTB
SCHEMBL2833656 0.82 NR1I2 (0.66) NR1I2LMNAPGRFNTAFNTB
SCHEMBL2838889 0.82 PTGS1 (0.36) NR1I2LMNAPGRALOX15ALDH1A1
SCHEMBL2837914 0.81 LMNA (0.55) NR1I2LMNAPGRFNTAFNTB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1866323-B1 GLUCURONIDATED NEBIVOLOL MYLAN LAB INC (US) 2017-05-31 EP disclosed
EP-1848424-B1 PHARMACEUTICAL COMPOSITION COMPRISING HYDROXYLATED NEBIVOLOL MYLAN LAB INC (US) 2017-04-05 EP disclosed
EP-2808015-A1 Compositions comprising nebivolol MYLAN LABORATORIES, INC (US) 2014-12-03 EP disclosed
US-7838552-B2 Compositions comprising nebivolol FOREST LABORATORIES HOLDINGS LIMITED (BM) 2010-11-23 US disclosed
EP-2174658-A1 Compositions comprising nebivolol MYLAN LABORATORIES, INC (US) 2010-04-14 EP disclosed
EP-1982711-A1 Compositions comprsing nebivolol MYLAN LABORATORIES, INC (US) 2008-10-22 EP disclosed
US-20080161296-A1 Compositions comprising nebivolol DEY, INC. (F/K/A DEY LABORATORIES, INC.) 2008-07-03 US disclosed
EP-1890691-A2 COMPOSITIONS COMRISING NEBIVOLOL MYLAN LABORATORIES, INC (US) 2008-02-27 EP disclosed
EP-1866323-A2 GLUCURONIDATED NEBIVOLOL MYLAN LABORATORIES, INC (US) 2007-12-19 EP disclosed
EP-1848424-A2 PHARMACEUTICAL COMPOSITION COMPRISING HYDROXYLATED NEBIVOLOL MYLAN LABORATORIES, INC (US) 2007-10-31 EP disclosed
WO-2006130174-A2 COMPOSITIONS COMRISING NEBIVOLOL MYLAN LABORATORIES, INC. (US) 2006-12-07 WO disclosed
WO-2006083779-A2 PHARMACEUTICAL COMPOSITION COMPRISING HYDROXYLATED NEBIVOLOL MYLAN LABORATORIES, INC. (US) 2006-08-10 WO disclosed
WO-2006083780-A2 GLUCURONIDATED NEBIVOLOL MYLAN LABORATORIES, INC. (US) 2006-08-10 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-20080161296-A1 Compositions comprising nebivolol ADRB1, ADRB3, ADRB2 NR1I2 554/4885LMNA 185/4885PGR 3963/4885

“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.