SCHEMBL5071937

SCHEMBL5071937

O=S(=O)(O)CCC1CCOC(c2ccccc2)C1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
KDM1A O60341 1/20 0.35
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
USP30 Q70CQ3 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
PTGES2 Q9H7Z7 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
SCHEMBL5069221 0.86 INPP5A (0.39) KDM4EMAPTHPGDTSHRKDM1A
SCHEMBL28656403 0.77 SLC18A3 (0.44) TSHRKDM1AMAOAMAOBSLC6A2
SCHEMBL5066891 0.76 MEN1 (0.40) MAPTTSHR
SCHEMBL17158548 0.72 INPP5A (0.37) KDM1AMAOAMAOBSLC6A2SLC6A4
SCHEMBL5069081 0.71 INPP5A (0.30)
SCHEMBL5066812 0.69 EPHX1 (0.33)
SCHEMBL1195857 0.69 TSHR (0.64) KDM4ETSHRMAOBSLC6A2SLC6A4
SCHEMBL8675407 0.69 TSHR (0.48) TSHRKDM1AMAOAMAOBSLC6A2
SCHEMBL1265907 0.69 TSHR (0.48) TSHRKDM1AMAOAMAOBSLC6A2
SCHEMBL1265905 0.69 TSHR (0.48) TSHRKDM1AMAOAMAOBSLC6A2

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-7365215-B2 Process for preparing 4-aminotetrahydropyran compound and an acid salt thereof, synthetic intermediate thereof and process for preparing the same UBE INDUSTRIES, LTD. (JP) 2008-04-29 US disclosed
US-20070106083-A1 Process for preparing 4-aminotetrahydropyran compound and an acid salt thereof, synthetic intermediate thereof and process for preparing the same UBE INDUSTRIES, LTD. (JP) 2007-05-10 US disclosed
EP-1661894-A1 PROCESS FOR PRODUCTION OF 4-AMINOTETRAHYDROPYRANS AND SALTS THEREOF WITH ACIDS, INTERMEDIATES FOR THE PROCESS, AND PROCESS FOR PRODUCTION THEREOF Ube Industries, Ltd. (JP) 2006-05-31 EP 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-20070106083-A1 Process for preparing 4-aminotetrahydropyran compound and an acid salt thereof, synthetic intermediate thereof and process for preparing the same PAH, HPD, REN KDM4E 1328/4885MAPT 2628/4885HPGD 33/4885

“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.