SCHEMBL8928205

SCHEMBL8928205

CCCC(=O)NCCCc1ccc(OC)c(OC)c1

nearest known ligand 0.85

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.63
KMT2A Q03164 2/20 0.63
MTNR1A P48039 1/20 0.62
MTNR1B P49286 1/20 0.62

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
SCHEMBL5192269 0.92 KMT2A (0.74) MEN1KMT2A
SCHEMBL9425666 0.89 MEN1 (0.70) MEN1KMT2A
SCHEMBL8269676 0.86 ALDH1A1 (0.72) MEN1KMT2A
SCHEMBL5212000 0.86 L3MBTL1 (0.72) MTNR1AMTNR1B
SCHEMBL27407288 0.85 EPHX2 (0.74) MEN1KMT2A
SCHEMBL13250284 0.85 MAPT (0.69) MEN1KMT2A
SCHEMBL23392535 0.85 MAPT (0.77) MEN1KMT2A
SCHEMBL23417617 0.85 ALDH1A1 (0.77) MEN1KMT2A
SCHEMBL7264887 0.83 MEN1 (0.51) MEN1KMT2A
SCHEMBL10841849 0.83 MTNR1A (0.62) KMT2AMTNR1AMTNR1B

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 5 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-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