SCHEMBL1724138

SCHEMBL1724138

CCC(=O)NC/C=C1/CCc2ccc(OC)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 8/20 1.00
MTNR1B P49286 8/20 1.00
NQO2 P16083 6/20 1.00
CYP19A1 P11511 4/20 0.46
CYP11B2 P19099 2/20 0.46
MAOB P27338 1/20 0.44

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
SCHEMBL1724140 1.00 MTNR1A (1.00) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL1724137 1.00 MTNR1A (1.00) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL4688512 0.89 MTNR1A (0.80) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL4688514 0.89 MTNR1A (0.80) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL4688517 0.89 MTNR1A (0.80) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL4689419 0.88 MTNR1A (0.78) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL4689417 0.88 MTNR1A (0.78) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL4689415 0.88 MTNR1A (0.78) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL7951201 0.86 MTNR1A (0.75) MTNR1AMTNR1BNQO2CYP19A1CYP11B2
SCHEMBL7951204 0.86 MTNR1A (0.75) MTNR1AMTNR1BNQO2CYP19A1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2406242-B1 PROCESS FOR THE PREPARATION OF RAMELTEON IND CHIMICA SRL (IT) 2013-06-05 EP disclosed
US-8242291-B2 Process for the preparation of ramelteon INDUSTRIALE CHIMICA S.R.L. (IT) 2012-08-14 US disclosed
EP-2406242-A1 PROCESS FOR THE PREPARATION OF RAMELTEON Industriale Chimica S.R.L. (IT) 2012-01-18 EP disclosed
WO-2010103553-A1 PROCESS FOR THE PREPARATION OF RAMELTEON INDUSTRIALE CHIMICA S.R.L. (IT) 2010-09-16 WO disclosed
US-20100234622-A1 PROCESS FOR THE PREPARATION OF RAMELTEON INDUSTRIALE CHIMICA S.R.L (IT) 2010-09-16 US disclosed
EP-0885210-B2 Tricylic compounds having binding affinity for melatonin receptors, their production and use TAKEDA PHARMACEUTICAL (JP) 2008-06-18 EP disclosed
EP-1550655-A1 Bicyclic intermediates Takeda Pharmaceutical Company Limited (JP) 2005-07-06 EP disclosed
EP-0885210-B1 Tricylic compounds having binding affinity for melatonin receptors, their production and use TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2002-06-12 EP disclosed
EP-1199304-A1 Bicyclic compounds and pharmaceutical composition containing tricyclic compound for treating or preventing sleep disorders Takeda Chemical Industries, Ltd. (JP) 2002-04-24 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
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 (1 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-20100234622-A1 PROCESS FOR THE PREPARATION OF RAMELTEON CYP2B6, CYP2A6, UGT1A6 MTNR1A 998/4885MTNR1B 779/4885NQO2 112/4885

“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.