SCHEMBL8941146

SCHEMBL8941146

CC(C)c1cccc(C(C)C)c1OS(=O)(=O)CC(=O)O

nearest known ligand 0.52

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.47
MYC P01106 1/20 0.47
SOAT1 P35610 1/20 0.47
MAP2K3 P46734 1/20 0.47

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
SCHEMBL8941512 0.86 SOAT2 (0.46) SOAT2MYCSOAT1MAP2K3
SCHEMBL8941282 0.83 SOAT2 (0.46) SOAT2MYCSOAT1MAP2K3
SCHEMBL8941392 0.81 SMN1; SMN2 (0.56) SOAT2MYCSOAT1MAP2K3
SCHEMBL8941187 0.80 TSHR (0.48) SOAT2MYCSOAT1MAP2K3
SCHEMBL4406110 0.78 SOAT2 (0.44) SOAT2MYCSOAT1MAP2K3
SCHEMBL8941313 0.76 SMN1; SMN2 (0.47) SOAT2MYCSOAT1MAP2K3
SCHEMBL17452138 0.75
SCHEMBL2458583 0.75
SCHEMBL9059766 0.75 FFAR1 (0.45)
SCHEMBL7566736 0.74 SOAT2 (0.60) SOAT2MYCSOAT1MAP2K3

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
WO-1996019444-A1 SULFONATE ACAT INHIBITORS WARNER-LAMBERT COMPANY (US) 1996-06-27 WO disclosed
US-5510379-A USEFUL FOR TREATING HYPERCHOLESTEROLEMIA AND ATHEROSCLEROSIS WARNER-LAMBERT COMPANY (US) 1996-04-23 US disclosed