SCHEMBL29670329

SCHEMBL29670329

Cc1cc(S(=O)(=O)NCCOCCOCCOCCOCCNC(=O)OC(C)(C)C)ccc1N

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 9/20 0.49
CA2 P00918 9/20 0.49
CA12 O43570 5/20 0.49
CA9 Q16790 5/20 0.49
ALDH1A1 P00352 1/20 0.45
ACACB O00763 1/20 0.42
ALPL P05186 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
SLC9A3 P48764 1/20 0.41
HTT P42858 1/20 0.40
FBP1 P09467 1/20 0.40
ALOX5 P09917 1/20 0.40
ALOX5AP P20292 1/20 0.39
FEN1 P39748 1/20 0.39
MAPK1 P28482 1/20 0.39

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
SCHEMBL22521201 0.97 CA1 (0.47) CA1CA2CA12CA9ALDH1A1
SCHEMBL30961785 0.88 CA1 (0.47) CA1CA2CA12CA9ALDH1A1
SCHEMBL22501375 0.87 ALDH1A1 (0.51) CA2ALDH1A1ALPLALPIALPG
SCHEMBL22520879 0.85 CA1 (0.54) CA1CA2CA12CA9ALDH1A1
SCHEMBL30371850 0.84 CA1 (0.52) CA1CA2CA12CA9ALDH1A1
SCHEMBL29393066 0.83 SLC9A3 (0.47) ALDH1A1ALPLALPIALPGSLC9A3
SCHEMBL29670422 0.82 MAPK1 (0.48) CA1CA2CA12CA9ALDH1A1
SCHEMBL3228310 0.82 CA2 (0.49) CA1CA2CA12CA9ALDH1A1
SCHEMBL15570246 0.82 CA1 (0.52) CA1CA2CA12CA9ALDH1A1
SCHEMBL15570395 0.82 CA1 (0.52) CA1CA2CA12CA9ALDH1A1

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-12466809-B2 CDK2/5 degraders and uses thereof DANA-FARBER CANCER INSTITUTE, INC. (US) 2025-11-11 US disclosed
EP-3947368-B1 BIFUNCTIONAL COMPOUNDS COMPRISING A CDK2/5 LIGAND, A LINKER AND A E3 UBIQUITIN LIGASE BINDING DEGRON FOR THE TREATMENT OF CANCER DANA FARBER CANCER INST INC (US) 2025-09-03 EP disclosed
US-20220153722-A1 CDK2/5 DEGRADERS AND USES THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2022-05-19 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-12466809-B2 CDK2/5 degraders and uses thereof CDK2, CDK5, CDK5R1 CA1 3862/4885CA2 3900/4885CA12 4158/4885
US-20220153722-A1 CDK2/5 DEGRADERS AND USES THEREOF CDK2, CDK5, CDK5R1 CA1 3862/4885CA2 3900/4885CA12 4158/4885

“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.