SCHEMBL339505

SCHEMBL339505

N#CC=C1CCc2ccc3c(c21)CCO3

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 11/20 0.36
MTNR1A P48039 11/20 0.36
HTR2A P28223 1/20 0.32
HTR2C P28335 1/20 0.32
HTR2B P41595 1/20 0.32
ABCB11 O95342 1/20 0.30
SIGMAR1 Q99720 1/20 0.30
USP2 O75604 1/20 0.30
DYRK1A Q13627 1/20 0.30
DYRK2 Q92630 1/20 0.30
DYRK1B Q9Y463 1/20 0.30

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
SCHEMBL1516337 1.00 MTNR1B (0.36) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL339504 1.00 MTNR1B (0.36) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL14206606 0.91 HTR2A (0.34) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL803827 0.80 MTNR1A (0.41) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL1555293 0.78 PARP1 (0.32)
SCHEMBL12394472 0.77 MTNR1A (0.40) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL4688545 0.76 MTNR1B (0.39) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL338471 0.76 MTNR1B (0.39) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL338470 0.76 MTNR1B (0.39) MTNR1BMTNR1AHTR2AHTR2CHTR2B
SCHEMBL805876 0.75 MTNR1A (0.41) MTNR1BMTNR1AHTR2AHTR2CHTR2B

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 52 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111116531-A Preparation method of ramelteon intermediate 山东省食品药品检验研究院 2020-05-08 CN claimed
EP-2406242-B1 PROCESS FOR THE PREPARATION OF RAMELTEON IND CHIMICA SRL (IT) 2013-06-05 EP claimed
US-8242291-B2 Process for the preparation of ramelteon INDUSTRIALE CHIMICA S.R.L. (IT) 2012-08-14 US claimed
EP-2406242-A1 PROCESS FOR THE PREPARATION OF RAMELTEON Industriale Chimica S.R.L. (IT) 2012-01-18 EP claimed
WO-2011027319-A1 PROCESS FOR THE PREPARATION OF AN INTERMEDIATE FOR RAMELTEON RANBAXY LABORATORIES LIMITED (IN) 2011-03-10 WO claimed
US-20100234622-A1 PROCESS FOR THE PREPARATION OF RAMELTEON INDUSTRIALE CHIMICA S.R.L (IT) 2010-09-16 US claimed
WO-2010103553-A1 PROCESS FOR THE PREPARATION OF RAMELTEON INDUSTRIALE CHIMICA S.R.L. (IT) 2010-09-16 WO claimed
WO-2010041271-A2 PROCESS FOR PREPARATION OF (S)-N-[2-(1,6,7,8-TETRAHYDRO-2H-INDENO[5,4-B]FURAN-8-YL)ETHYL] PROPIONAMIDE AND NOVEL INTERMEDIATES THEREOF USV LIMITED (IN) 2010-04-15 WO claimed
CN-118546047-B Preparation method of cyclic chiral nitrile compound and application of cyclic chiral nitrile compound in preparation of ramelteon 北京师范大学 2025-02-07 CN disclosed
CN-118546047-A Preparation method of cyclic chiral nitrile compound and application of cyclic chiral nitrile compound in preparation of ramelteon 北京师范大学 2024-08-27 CN disclosed
CN-117946050-A Preparation method of ramelteon impurity dimer 湖南慧泽生物医药科技有限公司 2024-04-30 CN disclosed
CN-111116531-A Preparation method of ramelteon intermediate 山东省食品药品检验研究院 2020-05-08 CN disclosed
US-10098866-B2 Pharmaceutical preparation containing copolyvidone TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-10-16 US disclosed
CN-106632177-A Preparation method of ramelteon intermediate 万特制药(海南)有限公司 2017-05-10 CN disclosed
EP-1100508-A2 PHARMACEUTICAL COMBINATION COMPRISING A TRICYCLIC COMPOUND AND AT LEAST ONE OF ZOLPIDEM, ZOPICLONE AND BROTIZOLAM FOR TREATING OR PREVENTING SLEEP DISORDERS Takeda Chemical Industries, Ltd. (JP) 2001-05-23 EP disclosed
US-6218429-B1 TREATING MELATONIN RELATED DISORDERS (E.G. CIRCARDIAN RHYTHMS, SLEEP-AWAKE CYCLES, TIME ZONE CHANGES, SLEEP DISORDERS) TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2001-04-17 US disclosed
US-6034239-A BINDIG TO MELATONIN RECEPTORS; SLEEP DISORDERS; GLANDULAR DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2000-03-07 US disclosed
WO-1999063977-A2 PHARMACEUTICAL COMBINATION COMPRISING A TRICYCLIC COMPOUND AND AT LEAST ONE OF ZOLPIDEM, ZOPICLONE, TRIAZOLAM AND BROTIZOLAM FOR TREATING OR PREVENTING SLEEP DISORDERS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-12-16 WO disclosed
EP-0885210-A1 Tricylic compounds having binding affinity for melatonin receptors, their production and use Takeda Chemical Industries, Ltd. (JP) 1998-12-23 EP disclosed
WO-1997032871-A1 TRICYCLIC COMPOUNDS, THEIR PRODUCTION AND USE TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1997-09-12 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10098866-B2 Pharmaceutical preparation containing copolyvidone PRCP, COPS6, COPS5 MTNR1B 3104/4885MTNR1A 3487/4885HTR2A 3093/4885
US-20100234622-A1 PROCESS FOR THE PREPARATION OF RAMELTEON CYP2B6, CYP2A6, UGT1A6 MTNR1B 779/4885MTNR1A 998/4885HTR2A 372/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.