SCHEMBL4880752

SCHEMBL4880752

COC(=O)C1(c2cccc(OC)c2)CCCN(c2ccccc2OC)CC1

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SOAT1 P35610 5/20 0.54
DRD4 P21917 6/20 0.48
DRD2 P14416 5/20 0.48
GFER P55789 1/20 0.47
HTR1A P08908 2/20 0.45
ADRA1D P25100 1/20 0.45
ADRA1A P35348 1/20 0.45
ADRA1B P35368 1/20 0.45
MAPT P10636 1/20 0.45

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
SCHEMBL4878061 0.96 SOAT1 (0.58) SOAT1DRD4DRD2HTR1AADRA1D
SCHEMBL4878235 0.92 SOAT1 (0.52) SOAT1DRD4DRD2HTR1AADRA1D
SCHEMBL14520389 0.88 SOAT1 (0.54) SOAT1DRD4DRD2
SCHEMBL14520390 0.88 SOAT1 (0.52) SOAT1DRD4GFERMAPT
SCHEMBL14520386 0.88 SOAT1 (0.49) SOAT1DRD4DRD2HTR1AADRA1D
SCHEMBL4873768 0.87 SOAT1 (0.55) SOAT1DRD4DRD2HTR1AADRA1D
SCHEMBL14520388 0.86 SOAT1 (0.50) SOAT1DRD4DRD2HTR1A
SCHEMBL5476169 0.86 SOAT1 (0.55) SOAT1DRD4DRD2HTR1AADRA1D
SCHEMBL14520387 0.85 CYP3A4 (0.54) SOAT1DRD2ADRA1AMAPT
SCHEMBL5477019 0.85 SOAT1 (0.54) SOAT1DRD4DRD2HTR1AADRA1D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080096922-A1 Novel Sulfonamide derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2008-04-24 US disclosed
EP-1736467-A1 NOVEL SULFONAMIDE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-12-27 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-20080096922-A1 Novel Sulfonamide derivative NR4A1, NR4A2, NR4A3 SOAT1 502/4885DRD4 191/4885DRD2 715/4885

“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.