SCHEMBL7709306

SCHEMBL7709306

CC(C)(C)OC(=O)NC1CCN(C2CCCc3ccc(O[Si](c4ccccc4)(c4ccccc4)C(C)(C)C)cc32)C1=O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 2/20 0.36
SCN9A Q15858 4/20 0.36
NPY1R P25929 1/20 0.34
RAMP1 O60894 3/20 0.33
CALCRL Q16602 3/20 0.33
DRD2 P14416 1/20 0.33
KMT2A Q03164 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL7721427 1.00 MTNR1B (0.36) MTNR1BSCN9ANPY1RRAMP1CALCRL
SCHEMBL7718518 1.00 MTNR1B (0.36) MTNR1BSCN9ANPY1RRAMP1CALCRL
SCHEMBL7719303 0.96 SCN9A (0.38) MTNR1BSCN9ANPY1RDRD2
SCHEMBL7717555 0.96 SCN9A (0.38) MTNR1BSCN9ANPY1RDRD2
SCHEMBL7713113 0.86 KDM4D (0.33) SCN9A
SCHEMBL7718967 0.86 KDM4D (0.33) SCN9A
SCHEMBL7718415 0.86 KDM4D (0.33) SCN9A
SCHEMBL7719034 0.79 MTNR1B (0.35) MTNR1BSCN9ANPY1RKMT2A
SCHEMBL7715083 0.78 KMT2A (0.34) NPY1RDRD2KMT2AL3MBTL1
SCHEMBL7717533 0.78 MTNR1B (0.35) MTNR1BKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6441017-B1 Inhibitors of prenyl-protein transferase MERCK & CO., INC. 2002-08-27 US disclosed
EP-1214326-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE Merck & Co., Inc. (US) 2002-06-19 EP disclosed
WO-2001018006-A1 INHIBITORS OF PRENYL-PROTEIN TRANSFERASE MERCK & CO., INC. (US) 2001-03-15 WO disclosed