SCHEMBL19690337

SCHEMBL19690337

OC[C@@H](O)c1cccc2c1CCO2

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 14/20 0.39
SLC9A1 P19634 2/20 0.37
MTNR1A P48039 12/20 0.36
USP9X Q93008 1/20 0.35
SLC9A5 Q14940 1/20 0.33
SLC9A2 Q9UBY0 1/20 0.33
ITGB2 P05107 1/20 0.33
ICAM1 P05362 1/20 0.33
ITGAL P20701 1/20 0.33

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
SCHEMBL19690338 1.00 MTNR1B (0.39) MTNR1BSLC9A1MTNR1AUSP9XSLC9A5
SCHEMBL31561726 0.85 MTNR1B (0.41) MTNR1BSLC9A1MTNR1ASLC9A5SLC9A2
SCHEMBL25108307 0.75 USP9X (0.43) MTNR1BSLC9A1MTNR1AUSP9XSLC9A5
SCHEMBL9910076 0.75 HTR2C (0.39) MTNR1BSLC9A1MTNR1ASLC9A5SLC9A2
SCHEMBL11329511 0.74 MTNR1B (0.37) MTNR1BSLC9A1MTNR1AUSP9XSLC9A5
SCHEMBL29793765 0.72 HTR2A (0.41) MTNR1BSLC9A1MTNR1ASLC9A5SLC9A2
SCHEMBL19682349 0.72 SLC9A1 (0.37) MTNR1BSLC9A1MTNR1ASLC9A5SLC9A2
SCHEMBL24469522 0.72 HTR2A (0.41) MTNR1BSLC9A1MTNR1ASLC9A5SLC9A2
SCHEMBL4447693 0.72 HTR2A (0.41) MTNR1BSLC9A1MTNR1ASLC9A5SLC9A2
SCHEMBL6192119 0.72 MTNR1B (0.46) MTNR1BSLC9A1MTNR1ASLC9A5SLC9A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9944616-B2 Processes for the preparation of Tasimelteon and intermediates thereof APOTEX INC. (CA) 2018-04-17 US disclosed
US-9944616-B2 Processes for the preparation of Tasimelteon and intermediates thereof APOTEX INC. (CA) 2018-04-17 US disclosed
US-9944616-B2 Processes for the preparation of Tasimelteon and intermediates thereof APOTEX INC. (CA) 2018-04-17 US disclosed
US-20170355688-A1 Processes for the Preparation of Tasimelteon and Intermediates Thereof THE BANK OF NOVA SCOTIA (CA) 2017-12-14 US disclosed
US-20170355688-A1 Processes for the Preparation of Tasimelteon and Intermediates Thereof THE BANK OF NOVA SCOTIA (CA) 2017-12-14 US disclosed
US-20170355688-A1 Processes for the Preparation of Tasimelteon and Intermediates Thereof THE BANK OF NOVA SCOTIA (CA) 2017-12-14 US 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-20170355688-A1 Processes for the Preparation of Tasimelteon and Intermediates Thereof TRMT1, SULT1A1, TMT1A MTNR1B 1442/4885SLC9A1 2520/4885MTNR1A 1616/4885

“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.