SCHEMBL13615626

SCHEMBL13615626

O=C(O)/C=C1\CCc2ccc3c(c21)CCO3

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 18/20 0.43
MTNR1B P49286 17/20 0.43
ABCB11 O95342 1/20 0.34
SIGMAR1 Q99720 1/20 0.34
USP2 O75604 1/20 0.34
KDM4E B2RXH2 1/20 0.34

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
SCHEMBL28357714 1.00 MTNR1A (0.43) MTNR1AMTNR1BABCB11SIGMAR1USP2
SCHEMBL4347797 1.00 MTNR1A (0.43) MTNR1AMTNR1BABCB11SIGMAR1USP2
SCHEMBL13705940 0.83 MTNR1A (0.40) MTNR1AMTNR1BABCB11SIGMAR1USP2
SCHEMBL803827 0.78 MTNR1A (0.41) MTNR1AMTNR1BABCB11SIGMAR1USP2
SCHEMBL12394472 0.76 MTNR1A (0.40) MTNR1AMTNR1BABCB11SIGMAR1USP2
SCHEMBL1516337 0.75 MTNR1B (0.36) MTNR1AMTNR1BABCB11SIGMAR1USP2
SCHEMBL338470 0.75 MTNR1B (0.39) MTNR1AMTNR1B
SCHEMBL4688545 0.75 MTNR1B (0.39) MTNR1AMTNR1B
SCHEMBL339505 0.75 MTNR1B (0.36) MTNR1AMTNR1BABCB11SIGMAR1USP2
SCHEMBL338471 0.75 MTNR1B (0.39) MTNR1AMTNR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-11-12 US disclosed
US-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-11-12 US disclosed
WO-2009056993-A2 A PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES TEVA PHARMACEUTICAL INDUSTRIES LTD. (IL) 2009-05-07 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-20090281176-A1 PROCESS FOR THE SYNTHESIS OF RAMELTEON AND ITS INTERMEDIATES CYP2B6, UGT1A6, CYP2A6 MTNR1A 2639/4885MTNR1B 2677/4885ABCB11 2855/4885

“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.