SCHEMBL3336334

SCHEMBL3336334

NC/C=C1\CCc2c(Br)c(Br)c3c(c21)CCO3

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2B P41595 2/20 0.36

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
SCHEMBL3336338 1.00 HTR2A (0.36) HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL3336319 0.98 HTR2A (0.35) HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL3336323 0.98 HTR2A (0.35) HTR2AHTR2CHTR2B
SCHEMBL3337706 0.76 HTR2A (0.31) HTR2AHTR2CHTR2B
SCHEMBL3337700 0.76 HTR2A (0.31) HTR2AHTR2CHTR2B
SCHEMBL338470 0.64 MTNR1B (0.39) HTR2AHTR2CHTR2B
SCHEMBL4688545 0.64 MTNR1B (0.39) HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL339103 0.63 MTNR1B (0.38) HTR2AHTR2CHTR2B
Hydrochloric Acid SCHEMBL339102 0.63 MTNR1B (0.38) HTR2AHTR2CHTR2B
SCHEMBL127576 0.62

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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
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

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-20100152468-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.