SCHEMBL7654883

SCHEMBL7654883

CC(=O)N(c1c(C(C)C)cc(C(C)C)cc1C(C)C)S(=O)(=O)Oc1c(C(C)C)cccc1C(C)C

nearest known ligand 0.55

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
SOAT2 O75908 1/20 0.51
MYC P01106 1/20 0.51
SOAT1 P35610 1/20 0.51
MAP2K3 P46734 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
SCHEMBL7103639 0.80
SCHEMBL5973624 0.77
SCHEMBL7565653 0.74 SOAT2 (0.63) SOAT2MYCSOAT1MAP2K3
SCHEMBL8343292 0.74 SOAT2 (0.42) SOAT2MYCSOAT1MAP2K3
SCHEMBL9136110 0.73
SCHEMBL9452038 0.72
SCHEMBL9136927 0.71
SCHEMBL7108589 0.71
SCHEMBL9137804 0.71
SCHEMBL9138808 0.71 LPAR1 (0.41)

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
EP-1263421-A2 THE DUAL INHIBITOR OF CHOLESTERYL ESTER AND WAX ESTER SYNTHESIS AVASIMIBE FOR TREATING SEBACEOUS GLAND DISORDERS Warner-Lambert Company LLC (US) 2002-12-11 EP disclosed
WO-2001056556-A2 DUAL INHIBITORS OF CHOLESTERYL ESTER AND WAX ESTER SYNTHESIS FOR SEBACEOUS GLAND DISORDERS WARNER-LAMBERT COMPANY (US) 2001-08-09 WO disclosed