SCHEMBL629696

SCHEMBL629696

CCC1(CC)CCc2cc(OC)ccc2C1=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.58
DGAT1 O75907 5/20 0.51
PRNP P04156 1/20 0.49
MPO P05164 1/20 0.49
CYP24A1 Q07973 2/20 0.44
METAP1 P53582 2/20 0.44
CYP27A1 Q02318 1/20 0.44
MALT1 Q9UDY8 1/20 0.44
MIF P14174 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA4 P22748 1/20 0.43
CA7 P43166 1/20 0.43
CA9 Q16790 1/20 0.43
MAPK14 Q16539 1/20 0.42
DRD2 P14416 1/20 0.42
HTR2A P28223 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42
SIGMAR1 Q99720 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
SCHEMBL4859219 0.88 SMN1; SMN2 (0.56) SMN1; SMN2DGAT1PRNPMPO
SCHEMBL4853241 0.88 SMN1; SMN2 (0.50) SMN1; SMN2DGAT1PRNPMPOCYP24A1
SCHEMBL14062077 0.86 SMN1; SMN2 (0.54) SMN1; SMN2DGAT1PRNPMPO
SCHEMBL629836 0.83 SMN1; SMN2 (0.53) SMN1; SMN2DGAT1PRNPMPOCYP24A1
SCHEMBL5287417 0.81 DGAT1 (0.45) SMN1; SMN2DGAT1DRD2
SCHEMBL630002 0.80 SMN1; SMN2 (0.66) SMN1; SMN2PRNPMPOMETAP1MALT1
SCHEMBL4857128 0.79 SMN1; SMN2 (0.52) SMN1; SMN2DGAT1PRNPMPOCYP24A1
SCHEMBL4857308 0.79 SMN1; SMN2 (0.46) SMN1; SMN2DGAT1PRNPMPOCYP24A1
SCHEMBL9587906 0.79 DGAT1 (0.45) DGAT1METAP1
SCHEMBL5282684 0.79 ESR2 (0.54) DGAT1

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 9 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
WO-2007000337-A1 BICYCLIC DERIVATIVES AS P38 KINASE INHIBITORS PALAU PHARMA, S.A. (ES) 2007-01-04 WO disclosed
US-5272170-A Tetralones with pharmacological activity J. URIACH & CIA., S.A. (ES) 1993-12-21 US disclosed
US-5208246-A Hypotensive, bronchodilator J. URIACH & CIA. (ES) 1993-05-04 US disclosed
EP-0489300-A2 Tetralones with pharmacological activity J. URIACH & CIA. S.A. (ES) 1992-06-10 EP 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 SMN1; SMN2 1966/4885DGAT1 586/4885PRNP 3712/4885

“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.