SCHEMBL31329634

SCHEMBL31329634

C[C@@H]1CC(=O)CCN1C(=O)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.54
PDK1 Q15118 1/20 0.53
PDK2 Q15119 1/20 0.53
PDK3 Q15120 1/20 0.53
PDK4 Q16654 1/20 0.53
PARP1 P09874 1/20 0.49
PSEN1 P49768 1/20 0.49
PSEN2 P49810 1/20 0.49
APH1B Q8WW43 1/20 0.49
NCSTN Q92542 1/20 0.49
APH1A Q96BI3 1/20 0.49
PSENEN Q9NZ42 1/20 0.49
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49

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
SCHEMBL1170552 1.00 HTR2C (0.54) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL754805 1.00 HTR2C (0.54) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL16903406 0.92 HTR2C (0.52) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL24837430 0.90 HTR2C (0.52) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL29182060 0.90 HTR2C (0.52) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL30118103 0.90 HTR2C (0.52) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL14209521 0.86 HTR2C (0.57) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL31114244 0.86 HTR2C (0.57) HTR2CPDK1PDK2PDK3PDK4
SCHEMBL21751143 0.86 PARP1 (0.47) HTR2CPARP1PSEN1PSEN2APH1B
SCHEMBL21326064 0.86 PARP1 (0.47) HTR2CPARP1PSEN1PSEN2APH1B

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
EP-4747253-A1 SPIROCYCLIC WRN HELICASE INHIBITORS Merck Sharp & Dohme LLC (US) 2026-05-27 EP disclosed
US-20260115174-A1 PHARMACOLOGICAL CORRECTORS OF RHODOPSIN AND USES THEREOF OCTANT INC (US) 2026-04-30 US disclosed
WO-2025014846-A1 SPIROCYCLIC WRN HELICASE INHIBITORS MERCK SHARP & DOHME LLC (US) 2025-01-16 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-20260115174-A1 PHARMACOLOGICAL CORRECTORS OF RHODOPSIN AND USES THEREOF PDE6D, PDE6H, ADRA1D HTR2C 544/4885PDK1 4522/4885PDK2 4793/4885

“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.