SCHEMBL7364717

SCHEMBL7364717

CC(=O)SCC1(C(=O)OC(C)(C)C)CCCC1

nearest known ligand 0.38

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.38
CYP4A11 Q02928 2/20 0.38
DGAT1 O75907 1/20 0.30

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
SCHEMBL3725050 0.79 CYP4F2 (0.47) CYP4F2CYP4A11
SCHEMBL1764252 0.77 CYP4F2 (0.42) CYP4F2CYP4A11DGAT1
SCHEMBL7359095 0.76 GHSR (0.34) CYP4F2CYP4A11
SCHEMBL15268879 0.75 CYP4F2 (0.38) CYP4F2CYP4A11DGAT1
SCHEMBL30736687 0.75 CYP4F2 (0.41) CYP4F2CYP4A11DGAT1
SCHEMBL6735060 0.75 SMN1; SMN2 (0.38)
SCHEMBL7365053 0.74 CYP2C19 (0.47) CYP4F2CYP4A11
SCHEMBL3295173 0.74 CYP4F2 (0.38) CYP4F2CYP4A11DGAT1
SCHEMBL15426304 0.73 P2RX7 (0.39)
SCHEMBL13048725 0.73 CYP4F2 (0.43) CYP4F2CYP4A11

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-5407960-A For cardiovascualr disorders, pain SCHERING CORPORATION (US) 1995-04-18 US disclosed
WO-1991009840-A1 MERCAPTOCYCLOACYL AMINOACID ENDOPEPTIDASE INHIBITORS SCHERING CORPORATION (US) 1991-07-11 WO disclosed