SCHEMBL8928098

SCHEMBL8928098

CCCC(=O)NCCCc1cc(OC)ccc1F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.63

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
SCHEMBL8928115 0.86 MTNR1A (0.74) MTNR1A
SCHEMBL8928099 0.84 MTNR1B (0.73) MTNR1A
SCHEMBL8928102 0.82 MTNR1B (0.55) MTNR1A
SCHEMBL14229734 0.80 CNR1 (0.56) MTNR1A
SCHEMBL8928245 0.79 MTNR1A (0.56) MTNR1A
SCHEMBL19304105 0.78 CHRM2 (0.54) MTNR1A
SCHEMBL14430371 0.77 POLB (0.61) MTNR1A
SCHEMBL8928119 0.77 MTNR1A (0.81) MTNR1A
SCHEMBL8928076 0.76 CNR1 (0.62) MTNR1A
SCHEMBL8033121 0.75 MTNR1A (0.84) MTNR1A

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 6 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-5652369-A PROTEASE INHIBITOR HOFFMANN-LA ROCHE INC. (US) 1997-07-29 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