SCHEMBL629707

SCHEMBL629707

C=C(C)C1CCc2cc(OCc3ccccc3)ccc2C1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FAAH O00519 13/20 0.60
HRH3 Q9Y5N1 7/20 0.54
CYP2D6 P10635 3/20 0.51
HRH1 P35367 1/20 0.51

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
SCHEMBL6747894 0.85 FAAH (0.68) FAAHHRH3CYP2D6
SCHEMBL8769199 0.83 FAAH (0.69) FAAHHRH3
SCHEMBL6751368 0.82 FAAH (0.67) FAAHHRH3
SCHEMBL630776 0.81 FAAH (0.64) FAAH
SCHEMBL18983590 0.81 HRH3 (0.59) FAAHHRH3CYP2D6HRH1
SCHEMBL9022793 0.79 FAAH (0.63) FAAHHRH3
SCHEMBL9170295 0.79 HRH3 (0.58) FAAHHRH3CYP2D6HRH1
SCHEMBL12472170 0.79 HRH3 (0.57) FAAHHRH3CYP2D6HRH1
SCHEMBL31344785 0.78 HRH3 (0.59) FAAHHRH3CYP2D6HRH1
SCHEMBL629897 0.78 HRH3 (0.54) FAAHHRH3CYP2D6HRH1

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
EP-1963292-B1 ORGANIC COMPOUNDS NOVARTIS AG (CH) 2012-02-22 EP disclosed
US-7700633-B2 Organic compounds NOVARTIS AG (CH) 2010-04-20 US disclosed
US-20080262050-A1 Organic Compounds NOVARTIS AG (CH) 2008-10-23 US disclosed
EP-1963292-A2 ORGANIC COMPOUNDS Novartis Pharma AG (CH) 2008-09-03 EP disclosed
WO-2007067615-A2 THIADIAZOLE DERIVATIVES AS ANTIDIABETIC AGENTS NOVARTIS AG (CH) 2007-06-14 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-20080262050-A1 Organic Compounds PTPRS, PTPRO, PTPRC FAAH 2966/4885HRH3 2417/4885CYP2D6 2951/4885

“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.