SCHEMBL29979124

SCHEMBL29979124

CNC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OCc1ccc(F)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSS P25774 4/20 0.48
▸ CTSK P43235 4/20 0.48
▸ MMP1 P03956 1/20 0.43
▸ PPARA Q07869 2/20 0.42
▸ CA2 P00918 2/20 0.41
▸ MEN1 O00255 3/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ MMP9 P14780 1/20 0.39
▸ MMP8 P22894 1/20 0.39
▸ PPARG P37231 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ CNR1 P21554 1/20 0.39
▸ CNR2 P34972 1/20 0.39
▸ SCN9A Q15858 1/20 0.38

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
SCHEMBL24812940 0.88 CTSS (0.50) CTSSCTSKPPARACA2PPARG
SCHEMBL30775625 0.88 CTSS (0.50) CTSSCTSKPPARACA2PPARG
SCHEMBL5556795 0.88 MMP1 (0.54) CTSSCTSKMMP1PPARAMEN1
SCHEMBL10708283 0.88 MMP1 (0.54) CTSSCTSKMMP1PPARAMEN1
SCHEMBL24815317 0.88 MMP1 (0.54) CTSSCTSKMMP1PPARAMEN1
SCHEMBL24815316 0.88 MMP1 (0.54) CTSSCTSKMMP1PPARAMEN1
SCHEMBL24812939 0.87 CTSS (0.47) CTSSCTSKPPARACA2MEN1
SCHEMBL19602658 0.87 CTSS (0.47) CTSSCTSKPPARACA2MEN1
SCHEMBL19602411 0.83 PPARA (0.47) CTSSCTSKPPARAMEN1KMT2A
SCHEMBL29979751 0.82 MMP1 (0.44) CTSSCTSKMMP1PPARACA2

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 CTSS 2818/4885CTSK 2237/4885MMP1 4041/4885
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 CTSS 2818/4885CTSK 2237/4885MMP1 4041/4885
US-12065445-B2 CDK2 inhibitors and methods of using the same CDK2, CDK20, CDK1 CTSS 3268/4885CTSK 2775/4885MMP1 3414/4885

“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.

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