SCHEMBL8928245

SCHEMBL8928245

COc1ccc(F)c(CCCNC(=O)C2CC2)c1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 8/20 0.56
MTNR1B P49286 6/20 0.55
ALDH1A1 P00352 2/20 0.55
KDM4E B2RXH2 1/20 0.53
CYP1A2 P05177 1/20 0.53
HSD17B10 Q99714 1/20 0.53

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
SCHEMBL8928212 0.86 MTNR1A (0.70) MTNR1AMTNR1BALDH1A1
SCHEMBL8928099 0.83 MTNR1B (0.73) MTNR1AMTNR1B
SCHEMBL8928102 0.81 MTNR1B (0.55) MTNR1AMTNR1BKDM4EHSD17B10
SCHEMBL8021679 0.79 MTNR1A (0.87) MTNR1AMTNR1B
SCHEMBL8928098 0.79 MTNR1A (0.63) MTNR1A
SCHEMBL8928226 0.78 MTNR1A (0.70) MTNR1AMTNR1BALDH1A1
SCHEMBL8928078 0.74 MTNR1A (0.65) MTNR1AMTNR1B
SCHEMBL20920062 0.74 EPHX2 (0.76) MTNR1AMTNR1BALDH1A1KDM4ECYP1A2
SCHEMBL14430371 0.73 POLB (0.61) MTNR1AMTNR1BHSD17B10
SCHEMBL8643878 0.73 MTNR1A (0.52) MTNR1AMTNR1BALDH1A1KDM4ECYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5541228-A Melatonergic agents BRISTOL-MYERS SQUIBB CO. (US) 1996-07-30 US claimed
EP-0706994-A1 Melatonergic agents BRISTOL-MYERS SQUIBB COMPANY (US) 1996-04-17 EP claimed
US-5698101-A Hollow fiber membranes MEMTEC LIMITED (AU) 1997-12-16 US disclosed
US-5661185-A AN ALKOXYPHENYL-ALKYLUREA COMPOUND TREATING SLEEP DISORDER BRISTOL-MYERS SQUIBB CO. (US) 1997-08-26 US disclosed
US-5541228-A Melatonergic agents BRISTOL-MYERS SQUIBB CO. (US) 1996-07-30 US disclosed
EP-0706994-A1 Melatonergic agents BRISTOL-MYERS SQUIBB COMPANY (US) 1996-04-17 EP disclosed
US-5395570-A Hollow fibre membrane extrusion MEMTEC LIMITED (AU) 1995-03-07 US disclosed
US-5318417-A Extrusion head for forming polymeric hollow fiber SIEMENS WATER TECHNOLOGIES CORP. 1994-06-07 US disclosed
EP-0423249-B1 EXTRUSION OF HOLLOW FIBRE MEMBRANES MEMTEC LTD (AU) 1994-03-23 EP disclosed
EP-0408688-B1 POROUS MEMBRANES MEMTEC LTD (AU) 1994-03-23 EP disclosed
US-5277851-A Removing surfactant from polyolefin fiber MEMTEC LIMITED (AU) 1994-01-11 US disclosed
EP-0423249-A4 EXTRUSION OF HOLLOW FIBRE MEMBRANES 1991-05-22 EP disclosed
EP-0423249-A1 EXTRUSION OF HOLLOW FIBRE MEMBRANES. MEMTEC LTD (AU) 1991-04-24 EP disclosed
EP-0408688-A4 POROUS MEMBRANES 1991-04-17 EP disclosed
EP-0408688-A1 POROUS MEMBRANES. MEMTEC LTD (AU) 1991-01-23 EP disclosed
WO-1990005007-A1 POROUS MEMBRANES MEMTEC LIMITED (AU) 1990-05-17 WO disclosed
WO-1990005006-A1 EXTRUSION OF HOLLOW FIBRE MEMBRANES MEMTEC LIMITED (AU) 1990-05-17 WO disclosed