SCHEMBL13484157

SCHEMBL13484157

CCS(=O)(=O)N[C@H]1CC[C@H](C=O)CC1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.39
CA7 P43166 2/20 0.39
CA14 Q9ULX7 2/20 0.39
SMYD3 Q9H7B4 1/20 0.38
JAK1 P23458 2/20 0.34
CA1 P00915 1/20 0.31
DRD2 P14416 4/20 0.31
HTR2A P28223 4/20 0.31
DRD3 P35462 4/20 0.31
IDH1 O75874 1/20 0.30
AR P10275 1/20 0.30
TYK2 P29597 1/20 0.30
ADH1B P00325 1/20 0.30
ADH1A P07327 1/20 0.30

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
SCHEMBL25270399 1.00 CA12 (0.39) CA12CA7CA14SMYD3JAK1
SCHEMBL1679362 0.85
SCHEMBL4756230 0.79 CA12 (0.42) CA12CA7CA14JAK1CA1
SCHEMBL19693509 0.79 CA12 (0.42) CA12CA7CA14JAK1CA1
SCHEMBL24940058 0.77 CA12 (0.44) CA12CA7CA14SMYD3JAK1
SCHEMBL25131032 0.77 CA12 (0.44) CA12CA7CA14SMYD3JAK1
SCHEMBL24043970 0.76 CA12 (0.54) CA12CA7CA14SMYD3CA1
SCHEMBL8392209 0.76 CA12 (0.48) CA12CA7CA14SMYD3CA1
SCHEMBL12764009 0.75 SMYD3 (0.46) CA12CA7CA14SMYD3JAK1
SCHEMBL13438572 0.74 CA12 (0.38) CA12CA7CA14CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025067111-A1 MENIN-MLL INTERACTION INHIBITOR AND PREPARATION METHOD THEREFOR, AND APPLICATION 苏州必扬医药科技有限公司 2025-04-03 WO disclosed
US-20250066358-A1 Inhibitors of Menin-MLL Interaction BALA THERAPEUTICS, INC. 2025-02-27 US disclosed
EP-4444313-A1 INHIBITORS OF MENIN-MLL INTERACTION Bala Therapeutics, Inc. (US) 2024-10-16 EP disclosed
CN-117412964-A Substituted heterocyclic compounds and their use 首药控股(北京)股份有限公司 2024-01-16 CN disclosed
WO-2023107687-A1 INHIBITORS OF MENIN-MLL INTERACTION BALA THERAPEUTICS, INC. (US) 2023-06-15 WO disclosed
WO-2022253309-A1 SUBSTITUTED HETEROCYCLIC COMPOUNDS AND APPLICATION THEREOF 首药控股(北京)股份有限公司 2022-12-08 WO disclosed
US-20100035996-A1 GLUCOSE METABOLISM STIMULATING AGENT SHIONOGI & CO LTD (JP) 2010-02-11 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 (2 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-20100035996-A1 GLUCOSE METABOLISM STIMULATING AGENT GPR119, GCKR, GHSR CA12 2972/4885CA7 2100/4885CA14 2784/4885
US-20250066358-A1 Inhibitors of Menin-MLL Interaction MLLT1, MEN1, BMI1 CA12 4343/4885CA7 4334/4885CA14 4577/4885

“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.