SCHEMBL21930188

SCHEMBL21930188

CCO[C@H]1CCN(C(=O)O)C1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
VNN1 O95497 2/20 0.41
GAA P10253 2/20 0.39
KCNK3 O14649 1/20 0.37
MAPT P10636 2/20 0.37
TAAR1 Q96RJ0 1/20 0.36
THRB P10828 1/20 0.36
ATM Q13315 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
ALDH1A1 P00352 4/20 0.35
NOS3 P29474 1/20 0.34
NOS2 P35228 1/20 0.34
TP53 P04637 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
ADORA2A P29274 2/20 0.34
ADORA2B P29275 2/20 0.34
PDE7B Q9NP56 1/20 0.34

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
SCHEMBL21929958 1.00 VNN1 (0.41) VNN1GAAKCNK3MAPTTAAR1
SCHEMBL12085750 1.00 VNN1 (0.41) VNN1GAAKCNK3MAPTTAAR1
SCHEMBL4433472 0.89 TAAR1 (0.46) VNN1MAPTTAAR1ALDH1A1
SCHEMBL4433475 0.89 TAAR1 (0.46) VNN1MAPTTAAR1ALDH1A1
SCHEMBL17672505 0.89 GAA (0.41) VNN1GAAMAPTTHRBATM
SCHEMBL12801554 0.85 VNN1 (0.41) VNN1GAAMAPTTHRBATM
SCHEMBL30395803 0.84 PDK2 (0.36) VNN1GAAMAPTTAAR1ALDH1A1
SCHEMBL22835340 0.84 ITGB3 (0.45) VNN1GAAMAPTTHRBATM
SCHEMBL1971626 0.84 ITGB3 (0.45) VNN1GAAMAPTTHRBATM
SCHEMBL25629786 0.84 PIK3CD (0.45) VNN1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230010358-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein PRELUDE THERAPEUTICS, INCORPORATED 2023-01-12 US disclosed
US-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein PRELUDE THERAPEUTICS, INCORPORATED (US) 2021-09-28 US disclosed
EP-3877390-A1 SPIRO-SULFONAMIDE DERIVATIVES AS INHIBITORS OF MYELOID CELL LEUKEMIA-1 (MCL-1) PROTEIN Prelude Therapeutics, Incorporated (US) 2021-09-15 EP disclosed
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein PRELUDE THERAPEUTICS, INCORPORATED 2020-05-14 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 (3 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-11130769-B2 Spiro-sulfonamide derivatives as inhibitors of myeloid cell leukemia-1 (MCL-1) protein MCL1, BCL2A1, BCL2L1 VNN1 3575/4885GAA 3509/4885KCNK3 2487/4885
US-20200148705-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein MCL1, BCL2A1, BCL2L1 VNN1 3575/4885GAA 3509/4885KCNK3 2487/4885
US-20230010358-A1 Spiro-Sulfonamide Derivatives As Inhibitors Of Myeloid Cell Leukemia-1 (MCL-1) Protein MCL1, BCL2A1, BCL2L1 VNN1 3575/4885GAA 3509/4885KCNK3 2487/4885

“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.