SCHEMBL805990

SCHEMBL805990

c1cc2c(c3c1CCC3)CCO2

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 3/20 0.39
HTR2C P28335 3/20 0.39
HTR2B P41595 3/20 0.39
MTNR1B P49286 9/20 0.35
MTNR1A P48039 8/20 0.35
KIF11 P52732 1/20 0.35
PRKCI P41743 1/20 0.34
PARP1 P09874 1/20 0.34
CLK1 P49759 1/20 0.34
DYRK1A Q13627 1/20 0.34
DYRK1B Q9Y463 1/20 0.34
ABCB11 O95342 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
USP2 O75604 1/20 0.33
NOTUM Q6P988 1/20 0.33
HTR1A P08908 1/20 0.33
HTR1D P28221 1/20 0.33
BCL2L1 Q07817 1/20 0.32
BAD Q92934 1/20 0.32

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
SCHEMBL29599480 1.00 HTR2A (0.39) HTR2AHTR2CHTR2BMTNR1BMTNR1A
SCHEMBL1143507 0.77 HTR2C (0.45) HTR2AHTR2CHTR2BMTNR1BMTNR1A
SCHEMBL23944932 0.76 PARP1 (0.46) KIF11PARP1BCL2L1BAD
SCHEMBL22743789 0.74 PNMT (0.42) HTR2AHTR2CHTR2B
SCHEMBL14204843 0.73 CES1 (0.40) HTR2AHTR2CHTR2BMTNR1BMTNR1A
SCHEMBL29599417 0.72 PARP1 (0.39) HTR2AHTR2CHTR2BKIF11PARP1
SCHEMBL1278375 0.71 BCL2L1 (0.52) KIF11PARP1SIGMAR1BCL2L1BAD
SCHEMBL18029587 0.71 NLRP3 (0.33) HTR2AHTR2CHTR2BPRKCICLK1
SCHEMBL9461283 0.69 BCL2L1 (0.50) KIF11PARP1SIGMAR1BCL2L1BAD
SCHEMBL27825033 0.68 KIF11 (0.35) HTR2AHTR2CHTR2BMTNR1BMTNR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023198882-A1 MELATONIN RECEPTOR AGONISTS FOR USE IN THE TREATMENT OF EPILEPSY DISORDERS THERACULE AS (NO) 2023-10-19 WO disclosed
WO-2021210920-A1 METHOD FOR PRODUCING RAMELTEON, AND INTERMEDIATE COMPOUND USED FOR SAME 제이투에이치바이오텍 주식회사 2021-10-21 WO disclosed
US-8084630-B2 Process for the synthesis of ramelteon and its intermediates TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-12-27 US disclosed
US-8084630-B2 Process for the synthesis of ramelteon and its intermediates TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2011-12-27 US disclosed
WO-2011027319-A1 PROCESS FOR THE PREPARATION OF AN INTERMEDIATE FOR RAMELTEON RANBAXY LABORATORIES LIMITED (IN) 2011-03-10 WO disclosed
WO-2011027323-A1 PROCESS FOR THE PREPARATION OF RAMELTEON RANBAXY LABORATORIES LIMITED (IN) 2011-03-10 WO disclosed
US-20100152468-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. 2010-06-17 US disclosed
US-20100152468-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. 2010-06-17 US disclosed
WO-2010045565-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2010-04-22 WO disclosed
US-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-11-12 US disclosed
EP-2098519-A1 Process for the synthesis of ramelteon and its intermediates Teva Pharmaceutical Industries Ltd. (IL) 2009-09-09 EP disclosed
WO-2009056993-A2 A PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-05-07 WO disclosed
US-20090069581-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-03-12 US disclosed
US-20090069581-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-03-12 US disclosed
WO-2008151170-A2 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2008-12-11 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 (3 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-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 HTR2A 2660/4885HTR2C 3006/4885HTR2B 3311/4885
US-20100152468-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 HTR2A 2028/4885HTR2C 2244/4885HTR2B 2806/4885
US-20090069581-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 HTR2A 2028/4885HTR2C 2244/4885HTR2B 2806/4885

“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.