SCHEMBL4290508

SCHEMBL4290508

C[C@@H]1[C]=CCc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.35
HTR2C P28335 1/20 0.35
HTR2B P41595 1/20 0.35
OPRM1 P35372 3/20 0.33
PDPK1 O15530 1/20 0.33
ALDH1A1 P00352 1/20 0.33
MAPT P10636 1/20 0.33
HRH1 P35367 2/20 0.32
PRCP P42785 1/20 0.32

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
SCHEMBL458495 1.00 HTR2A (0.35) HTR2AHTR2CHTR2BOPRM1PDPK1
SCHEMBL6521360 1.00 HTR2A (0.35) HTR2AHTR2CHTR2BOPRM1PDPK1
SCHEMBL3389204 0.77 HTR2A (0.35) HTR2AHTR2CPDPK1HRH1
SCHEMBL8890669 0.76 CHRNB2 (0.33) HTR2AOPRM1PDPK1
SCHEMBL4307808 0.75 HTR2A (0.34) HTR2AHTR2CHRH1
SCHEMBL874497 0.75 HTR2A (0.34) HTR2AHTR2CHRH1
SCHEMBL455932 0.75 HTR2A (0.34) HTR2AHTR2COPRM1HRH1
SCHEMBL458123 0.75 HTR2A (0.34) HTR2AHTR2CHRH1
SCHEMBL7883084 0.75 HTR2A (0.37) HTR2AHTR2CHTR2BHRH1
SCHEMBL8679592 0.75 HTR2A (0.37) HTR2AHTR2CHTR2BHRH1

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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050101525-A1 METHOD OF COMPLEXING A NUCLEIC ACID WITH A LIPID-CONJUGATED POLYAMIDE ZUCKERMANN RONALD N (US) 2005-05-12 US claimed
EP-1003558-B1 LIPID-POLYAMIDE CONJUGATES AND COMPOSITIONS FOR NUCLEIC ACID DELIVERY CHIRON CORP (US) 2004-03-17 EP claimed
US-20040018962-A1 Lipid-conjugated polyamide compounds CHIRON CORPORATION 2004-01-29 US claimed
US-6572881-B1 Delivery of polynucleotides to cells; polylactam CHIRON CORPORATION 2003-06-03 US claimed
US-6569450-B1 For facilitating the delivery of polynucleotides to cells CHIRON CORPORATION 2003-05-27 US claimed
US-6197332-B1 ACYLATION AND AMIDATION TO FORM POLYAMIDES FOR CONJUGATED LIPIDS CHIRON CORPORATION 2001-03-06 US claimed
EP-1003558-A1 LIPID-POLYAMIDE CONJUGATES AND COMPOSITIONS FOR NUCLEIC ACID DELIVERY CHIRON CORPORATION (US) 2000-05-31 EP claimed
WO-1999008711-A1 LIPID-POLYAMIDE CONJUGATES AND COMPOSITIONS FOR NUCLEIC ACID DELIVERY CHIRON CORPORATION (US) 1999-02-25 WO claimed
US-20150031743-A1 CELL TRANSFECTING FORMULATIONS OF SMALL INTERFERING RNA, RELATED COMPOSITIONS AND METHODS OF MAKING AND USE NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2015-01-29 US disclosed
US-8772255-B2 Cell transfecting formulations of small interfering RNA related compositions and methods of making and use NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2014-07-08 US disclosed
EP-1709195-B1 CELL TRANSFECTING FORMULATIONS OF SMALL INTERFERING RNA, RELATED COMPOSITIONS AND METHODS OF MAKING AND USE NOVARTIS VACCINES & DIAGNOSTIC (US) 2014-01-22 EP disclosed
US-20090143322-A1 CELL TRANSFECTING FORMULATIONS OF SMALL INTERFERING RNA RELATED COMPOSITIONS AND METHODS OF MAKING AND USE CHIRON CORPORATION (US) 2009-06-04 US disclosed
US-7214384-B2 Lipid-conjugated polyamide compounds NOVARTIS VACCINES AND DIAGNOSTICS, INC. (US) 2007-05-08 US disclosed
US-20060019912-A1 Cell transfecting formulations of small interfering RNA related compositions and methods of making and use CHIRON CORPORATION 2006-01-26 US disclosed
US-20040018962-A1 Lipid-conjugated polyamide compounds CHIRON CORPORATION 2004-01-29 US disclosed
US-6572881-B1 Delivery of polynucleotides to cells; polylactam CHIRON CORPORATION 2003-06-03 US disclosed
US-6569450-B1 For facilitating the delivery of polynucleotides to cells CHIRON CORPORATION 2003-05-27 US disclosed
US-6197332-B1 ACYLATION AND AMIDATION TO FORM POLYAMIDES FOR CONJUGATED LIPIDS CHIRON CORPORATION 2001-03-06 US disclosed
EP-1003558-A1 LIPID-POLYAMIDE CONJUGATES AND COMPOSITIONS FOR NUCLEIC ACID DELIVERY CHIRON CORPORATION (US) 2000-05-31 EP disclosed
WO-1999008711-A1 LIPID-POLYAMIDE CONJUGATES AND COMPOSITIONS FOR NUCLEIC ACID DELIVERY CHIRON CORPORATION (US) 1999-02-25 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 (5 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-20060019912-A1 Cell transfecting formulations of small interfering RNA related compositions and methods of making and use SNRPE, SNRPA, PHAX HTR2A 4604/4885HTR2C 4789/4885HTR2B 4671/4885
US-20090143322-A1 CELL TRANSFECTING FORMULATIONS OF SMALL INTERFERING RNA RELATED COMPOSITIONS AND METHODS OF MAKING AND USE SNRPE, SNRPA, PHAX HTR2A 4604/4885HTR2C 4789/4885HTR2B 4671/4885
US-20150031743-A1 CELL TRANSFECTING FORMULATIONS OF SMALL INTERFERING RNA, RELATED COMPOSITIONS AND METHODS OF MAKING AND USE SNRPE, PHAX, SNRPA HTR2A 4493/4885HTR2C 4764/4885HTR2B 4654/4885
US-20040018962-A1 Lipid-conjugated polyamide compounds LPCAT3, PHOSPHO1, LPCAT1 HTR2A 4680/4885HTR2C 4832/4885HTR2B 4827/4885
US-20050101525-A1 METHOD OF COMPLEXING A NUCLEIC ACID WITH A LIPID-CONJUGATED POLYAMIDE POLRMT, POLI, LPCAT3 HTR2A 4598/4885HTR2C 4828/4885HTR2B 4817/4885

“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.