SCHEMBL7479219

SCHEMBL7479219

CC(C)(C)OC(=O)Nc1cccc(CO[Si](c2ccccc2)(c2ccccc2)C(C)(C)C)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
PDE5A O76074 3/20 0.39
CCR2 P41597 1/20 0.39
TOP2A P11388 1/20 0.37
TOP2B Q02880 1/20 0.37
ACSS2 Q9NR19 1/20 0.37
SCN9A Q15858 4/20 0.37
MAPK1 P28482 1/20 0.37
NR3C2 P08235 1/20 0.36
CYP2C9 P11712 1/20 0.36
PTGER1 P34995 1/20 0.36
PPARA Q07869 1/20 0.35
PTGER2 P43116 2/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA7 P43166 1/20 0.35

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
SCHEMBL13323079 0.83 MAPK1 (0.40) MEN1NPC1GAARAB9AKMT2A
SCHEMBL20098837 0.81 CDK5 (0.44) MEN1NPC1GAARAB9AKMT2A
SCHEMBL13141093 0.80 CCR2 (0.41) MEN1NPC1GAARAB9AKMT2A
SCHEMBL2828644 0.79 CCR2 (0.40) MEN1NPC1GAARAB9AKMT2A
SCHEMBL3427899 0.79 PDE5A (0.50) MEN1NPC1GAARAB9AKMT2A
SCHEMBL4076010 0.79 CHRNB2 (0.51) CCR2SCN9ANR3C2CYP2C9
SCHEMBL30396325 0.79 CCR2 (0.42) MEN1NPC1GAARAB9AKMT2A
SCHEMBL465792 0.79 CCR2 (0.42) MEN1NPC1GAARAB9AKMT2A
SCHEMBL30071195 0.78 NAMPT (0.43) MEN1NPC1GAARAB9AKMT2A
SCHEMBL31160269 0.78 SIRT2 (0.47) TOP2ATOP2BACSS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0930298-B1 FLUORINATED 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-12-18 EP disclosed
US-6040449-A USEFUL FOR FORMING FLUORINE CONTAINING 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES, USEFUL AS ANTAGONIST FOR MUSCARINIC M3 RECEPTORS AND LESS SIDE EFFECT BANYU PHARMACEUTICAL CO LTD (JP) 2000-03-21 US disclosed
US-5948792-A POTENT AND SELECTIVE ANTAGONISTS FOR MUSCARINIC M.SUB.3 RECEPTORS WITH LITTLE SIDE EFFECTS. BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-09-07 US disclosed
EP-0930298-A1 FLUORINATED 1,4-DISUBSTITUTED PIPERIDINE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-07-21 EP disclosed