SCHEMBL29979072

SCHEMBL29979072

CNC(=O)[C@H](CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)NC(=O)OC(C)(C)C

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSS P25774 9/20 0.48
PPARA Q07869 5/20 0.48
CTSK P43235 7/20 0.46
CTSB P07858 2/20 0.46
CTSL P07711 1/20 0.46
PPARG P37231 4/20 0.46
MMP13 P45452 2/20 0.43
ACE P12821 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
PPARD Q03181 2/20 0.42
HDAC8 Q9BY41 1/20 0.41

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
SCHEMBL15448116 0.89 PPARA (0.57) CTSSPPARACTSKCTSBCTSL
SCHEMBL17291652 0.89 PPARA (0.57) CTSSPPARACTSKCTSBCTSL
SCHEMBL20974785 0.89 PPARA (0.57) CTSSPPARACTSKCTSBCTSL
SCHEMBL31385360 0.87 CTSS (0.48) CTSSPPARACTSKCTSBCTSL
SCHEMBL25361007 0.87 KLK5 (0.47) CTSSPPARACTSKCTSBCTSL
SCHEMBL31385404 0.87 PPARA (0.46) CTSSPPARACTSKCTSBCTSL
SCHEMBL3753366 0.87 KLK5 (0.47) CTSSPPARACTSKCTSBCTSL
SCHEMBL3753362 0.87 KLK5 (0.47) CTSSPPARACTSKCTSBCTSL
SCHEMBL31385263 0.86 PPARA (0.46) CTSSPPARACTSKCTSBCTSL
SCHEMBL28684646 0.85 CYP1A2 (0.46) CTSSPPARACTSKCTSBCTSL

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 2818/4885PPARA 3679/4885CTSK 2237/4885
US-20230109076-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CDK2, CDK20, CDK2AP2 CTSS 2818/4885PPARA 3679/4885CTSK 2237/4885
US-12065445-B2 CDK2 inhibitors and methods of using the same CDK2, CDK20, CDK1 CTSS 3268/4885PPARA 3800/4885CTSK 2775/4885

“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.