SCHEMBL5437335

SCHEMBL5437335

CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1COS(C)(=O)=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 1/20 0.42
MAOB P27338 2/20 0.37
MAOA P21397 1/20 0.37
EPHX1 P07099 1/20 0.37
KMT2A Q03164 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 2/20 0.35
CTSK P43235 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
KDM1A O60341 2/20 0.34
CA1 P00915 2/20 0.34
CA2 P00918 1/20 0.34
HDAC4 P56524 1/20 0.33
HDAC6 Q9UBN7 1/20 0.33
F2 P00734 1/20 0.33
F10 P00742 1/20 0.33
PRSS1 P07477 1/20 0.33
CCR1 P32246 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
SCHEMBL6104225 1.00 BTK (0.42) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL30993106 1.00 BTK (0.42) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL647683 0.97 EPHX1 (0.40) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL5427832 0.97 EPHX1 (0.40) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL4689755 0.97 EPHX1 (0.40) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL17956680 0.92 MAOB (0.39) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL17956679 0.92 MAOB (0.39) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL17970278 0.92 MAOB (0.39) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL19363763 0.81 GAA (0.41) BTKMAOBMAOAEPHX1KMT2A
SCHEMBL17987640 0.81 GAA (0.41) BTKMAOBMAOAEPHX1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260085056-A1 OX1 RECEPTOR ANTAGONISTS NXERA PHARMA UK LIMITED (GB) 2026-03-26 US disclosed
US-12331029-B2 Orexin 1 receptor antagonists NXERA PHARMA UK LIMITED (GB) 2025-06-17 US disclosed
US-12240825-B2 Oxexin 1 receptor antagonists NXERA PHARMA UK LIMITED (GB) 2025-03-04 US disclosed
US-20220098165-A1 OXEXIN 1 RECEPTOR ANTAGONISTS NXERA PHARMA UK LIMITED (GB) 2022-03-31 US disclosed
US-20070185079-A1 Therapeutic agents I ASTRAZENECA AB (SE) 2007-08-09 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 (5 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-20220098165-A1 OXEXIN 1 RECEPTOR ANTAGONISTS HCRTR1, HCRTR2, OXTR BTK 1939/4885MAOB 486/4885MAOA 485/4885
US-12240825-B2 Oxexin 1 receptor antagonists HCRTR1, HCRTR2, OXTR BTK 1939/4885MAOB 486/4885MAOA 485/4885
US-20260085056-A1 OX1 RECEPTOR ANTAGONISTS CNR1, CNR2, OPRM1 BTK 1371/4885MAOB 118/4885MAOA 133/4885
US-12331029-B2 Orexin 1 receptor antagonists HCRTR1, HCRTR2, NPY1R BTK 3303/4885MAOB 370/4885MAOA 385/4885
US-20070185079-A1 Therapeutic agents I HTT, GRIN2A, GRIN1 BTK 4356/4885MAOB 754/4885MAOA 805/4885

“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.