SCHEMBL5724608

SCHEMBL5724608

CC(C)C[C@@H](CO)NC(=O)OCc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ CTSK P43235 11/20 0.62
▸ CTSS P25774 3/20 0.58
▸ CTSL P07711 3/20 0.58
▸ CTSB P07858 2/20 0.58
▸ CTRB1 P17538 2/20 0.58
▸ PSMB1 P20618 1/20 0.56
▸ PSMB5 P28074 1/20 0.56
▸ PSMB2 P49721 1/20 0.56
▸ ATM Q13315 1/20 0.54
▸ CAPN1 P07384 1/20 0.54
▸ CAPN2 P17655 1/20 0.54

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
SCHEMBL2723504 1.00 CTSK (0.62) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL14923444 1.00 CTSK (0.62) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL8971948 0.90 CTSK (0.72) CTSKCTSSCTSLCTSBPSMB1
SCHEMBL10983417 0.89 CTSK (0.60) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL10983415 0.89 CTSK (0.60) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL14595271 0.89 CTSK (0.64) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL13074183 0.89 CTSK (0.64) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL4829896 0.88 CTRB1 (0.68) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL25182274 0.87 CTSK (0.61) CTSKCTSSCTSLCTSBCTRB1
SCHEMBL2724462 0.87 CTSK (0.61) CTSKCTSSCTSLCTSBCTRB1

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 113 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4596051-A2 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION Pharmacosmos Holding A/s (DK) 2025-08-06 — — EP disclosed
US-12285431-B2 Treatment of Rb-negative tumors using topoisomerase inhibitors in combination with cyclin dependent kinase 4/6 inhibitors PHARMACOSMOS HOLDING A/S (DK) 2025-04-29 — — US disclosed
EP-2968291-B1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION PHARMACOSMOS HOLDING AS (DK) 2025-04-16 — — EP disclosed
US-20240109906-A1 CDK INHIBITORS G1 THERAPEUTICS, INC. (US) 2024-04-04 — — US disclosed
CN-117402189-A Phosphoramidate (phosphonate) acetals and phospho (phosphonate) acetal compounds 广东集宝医药技术有限公司 2024-01-16 — — CN disclosed
US-20230381189-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY G1 THERAPEUTICS, INC. (US) 2023-11-30 — — US disclosed
US-20230364098-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION G1 THERAPEUTICS, INC. (US) 2023-11-16 — — US disclosed
CN-111836818-B Phosphoramidate (phosphonate) acetals and phospho (phosphonate) acetal compounds 纽科利制药公司 2023-10-31 — — CN disclosed
US-20230248733-A1 HIGHLY ACTIVE ANTI-NEOPLASTIC AND ANTI-PROLIFERATIVE AGENTS G1 THERAPEUTICS, INC. (US) 2023-08-10 — — US disclosed
US-11717523-B2 Transient protection of normal cells during chemotherapy G1 THERAPEUTICS, INC. (US) 2023-08-08 — — US disclosed
EP-0680467-B1 PROCESS FOR PREPARING C-SUBSTITUTED DIETHYLENE TRIAMINES SCHERING AG (DE) 1998-04-22 — — EP disclosed
US-5733522-A USEFUL FOR NMR DIAGNOSIS AND DIAGNOSTIC RADIOLOGY; FOR CONTRASTING THE HEPATOBILIARY SYSTEM SCHERING AKTIENGESELLSCHAFT (DE) 1998-03-31 — — US disclosed
US-5654467-A Process for the production of C-substituted diethylenetriamines SCHERING AKTIENGESELLSCHAFT (DE) 1997-08-05 — — US disclosed
EP-0680464-B1 DERIVATED DTPA COMPLEXES, PHARMACEUTICALS CONTAINING THESE COMPOUNDS, THEIR USE AS NMR- AND RADIOGRAPHIC CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME SCHERING AG (DE) 1997-04-09 — — EP disclosed
WO-1997003679-A1 PHOSPHOROUS-CONTAINING CYSTEINE AND SERINE PROTEASE INHIBITORS CEPHALON, INC. (US) 1997-02-06 — — WO disclosed
EP-0680464-A1 DERIVATED DTPA COMPLEXES, PHARMACEUTICALS CONTAINING THESE COMPOUNDS, THEIR USE AS NMR- AND RADIOGRAPHIC CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME. SCHERING AG (DE) 1995-11-08 — — EP disclosed
EP-0680467-A1 PROCESS FOR PREPARING C-SUBSTITUTED DIETHYLENE TRIAMINES SCHERING AKTIENGESELLSCHAFT (DE) 1995-11-08 — — EP disclosed
WO-1994017029-A1 DERIVATED DTPA COMPLEXES, PHARMACEUTICALS CONTAINING THESE COMPOUNDS, THEIR USE AS NMR- AND RADIOGRAPHIC CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME SCHERING AKTIENGESELLSCHAFT (DE) 1994-08-04 — — WO disclosed
WO-1994017033-A1 PROCESS FOR PREPARING C-SUBSTITUTED DIETHYLENE TRIAMINES SCHERING AKTIENGESELLSCHAFT (DE) 1994-08-04 — — WO disclosed
US-4180565-A ANTIBACTERIAL AGENTS, ANTIBIOTICS SCHERING CORPORATION (US) 1979-12-25 — — 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 (6 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-20240109906-A1 CDK INHIBITORS CDK3, CDK9, CDK6 CTSK 1426/4885CTSS 2527/4885CTSL 2084/4885
US-20230364098-A1 HSPC-SPARING TREATMENTS FOR RB-POSITIVE ABNORMAL CELLULAR PROLIFERATION RB1, CDK4, CDKN1A CTSK 2543/4885CTSS 2763/4885CTSL 2899/4885
US-12285431-B2 Treatment of Rb-negative tumors using topoisomerase inhibitors in combination with cyclin dependent kinase 4/6 inhibitors RB1, CDK4, CDK6 CTSK 2201/4885CTSS 3037/4885CTSL 2542/4885
US-20230248733-A1 HIGHLY ACTIVE ANTI-NEOPLASTIC AND ANTI-PROLIFERATIVE AGENTS MKI67, PCNA, HRAS CTSK 1306/4885CTSS 1268/4885CTSL 1154/4885
US-20230381189-A1 TRANSIENT PROTECTION OF NORMAL CELLS DURING CHEMOTHERAPY CDK6, CCNC, MCL1 CTSK 1517/4885CTSS 2739/4885CTSL 1815/4885
US-11717523-B2 Transient protection of normal cells during chemotherapy CDK6, CCNC, MCL1 CTSK 1517/4885CTSS 2739/4885CTSL 1815/4885

“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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