SCHEMBL29979749

SCHEMBL29979749

CC(C)(C)OC(=O)N[C@@H]1CCCN(C(=O)C2CCCCC2)C1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 2/20 0.65
CA2 P00918 2/20 0.65
BTK Q06187 2/20 0.53
CTSK P43235 2/20 0.50
HPGD P15428 1/20 0.50
HSD11B1 P28845 3/20 0.48
CYP2C9 P11712 1/20 0.48
EPHX1 P07099 2/20 0.48
GFER P55789 1/20 0.46
GAA P10253 1/20 0.46
JAK3 P52333 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.43
MAPT P10636 1/20 0.43
KMT2A Q03164 1/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 1/20 0.43
USP30 Q70CQ3 1/20 0.43
HTT P42858 1/20 0.43

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
SCHEMBL1159627 0.96 CA1 (0.67) CA1CA2BTKCTSKHPGD
SCHEMBL1159629 0.96 CA1 (0.67) CA1CA2BTKCTSKHPGD
SCHEMBL15731609 0.86 HSD11B1 (0.58) CA1CA2BTKCTSKHPGD
SCHEMBL3487489 0.83 CA1 (0.71) CA1CA2BTKCTSKHSD11B1
SCHEMBL1467769 0.83 CA1 (0.71) CA1CA2BTKCTSKHSD11B1
SCHEMBL31334523 0.83 CA1 (0.71) CA1CA2BTKCTSKHSD11B1
SCHEMBL1159171 0.83 CA1 (0.71) CA1CA2BTKCTSKHSD11B1
SCHEMBL3487968 0.83 CA1 (0.71) CA1CA2BTKCTSKHSD11B1
SCHEMBL1159172 0.83 CA1 (0.71) CA1CA2BTKCTSKHSD11B1
SCHEMBL17545919 0.83 CA1 (0.71) CA1CA2BTKCTSKHSD11B1

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-12065445-B2 CDK2 inhibitors and methods of using the same CEDILLA THERAPEUTICS, INC. (US) 2024-08-20 US disclosed
US-20240174680-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-05-30 US disclosed
EP-4284365-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2023-12-06 EP disclosed
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. 2023-04-06 US disclosed
WO-2022165513-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2022-08-04 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 (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-20240174680-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 CA1 3740/4885CA2 3554/4885BTK 647/4885
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 CA1 3740/4885CA2 3554/4885BTK 647/4885
US-12065445-B2 CDK2 inhibitors and methods of using the same CDK2, CDK20, CDK1 CA1 2850/4885CA2 1979/4885BTK 304/4885

“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.