Palbociclib

Palbociclib

SCHEMBL29425547

CC(=O)c1c(C)c2cnc(Nc3ccc(N4CCNCC4)cn3)nc2n(C2CCCC2)c1=O.Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

CCND1CDK4CDK6

The experimentally established mechanism targets of Palbociclib. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK4 known ✓ P11802 20/20 1.00
▸ CCND1 known ✓ P24385 16/20 1.00
▸ CDK6 known ✓ Q00534 5/20 0.98
▸ CCND3 P30281 13/20 0.98
▸ CCND2 P30279 12/20 0.98
▸ CDK2 P24941 5/20 0.98
▸ CCNA2 P20248 4/20 0.98
▸ CCNA1 P78396 2/20 0.98
▸ CDK9 P50750 2/20 0.98
▸ CHEK1 O14757 1/20 0.98
▸ DAPK3 O43293 1/20 0.98
▸ CCNT1 O60563 1/20 0.98
▸ CCNT2 O60583 1/20 0.98
▸ ROCK2 O75116 1/20 0.98
▸ STK16 O75716 1/20 0.98
▸ CCNK O75909 1/20 0.98
▸ PDE5A O76074 1/20 0.98
▸ PRKD3 O94806 1/20 0.98
▸ CCNB2 O95067 1/20 0.98
▸ ABCB11 O95342 1/20 0.98

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
Palbociclib SCHEMBL2076416 1.00 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL29387795 1.00 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL29379411 0.99 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL30584526 0.99 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL462630 0.99 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL29362383 0.99 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Hydrochloric Acid SCHEMBL4828453 0.98 CDK4 (0.98) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL28567292 0.98 CDK4 (0.97) CDK4CCND1CCND3CCND2CDK2
SCHEMBL4827183 0.97 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
SCHEMBL30176561 0.97 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120189510-A Application of fused ring compound 北京哲源科技有限责任公司 2025-06-24 — — CN claimed
CN-117899085-A Pharmaceutical composition and pharmaceutical preparation for improving success rate of full-thickness skin grafting and application thereof 无锡市南京大学锡山应用生物技术研究所 2024-04-19 — — CN claimed
CN-114181905-B Exosome easy to penetrate blood brain barrier 南京中医药大学 2024-03-22 — — CN claimed
US-20230183323-A1 METHODS FOR PREVENTING, REVERSING OR TREATING A COVID-19 INFECTION BROWN UNIVERSITY 2023-06-15 — — US claimed
CN-115721724-A Pharmaceutical composition containing secondary amine compound and preparation and application thereof 山东威智中科药业有限公司 2023-03-03 — — CN claimed
CN-114181905-A Exosome easy to permeate blood brain barrier 南京中医药大学 2022-03-15 — — CN claimed
EP-4048809-B1 SYSTEMS AND METHODS FOR PREDICTING THERAPEUTIC SENSITIVITY TEMPUS AI INC (US) 2026-05-27 — — EP disclosed
EP-4729940-A2 LARGE SCALE ORGANOID ANALYSIS Tempus AI, Inc. (US) 2026-04-22 — — EP disclosed
US-20260103678-A1 BILAYER OF RETINAL PIGMENTED EPITHELIUM AND PHOTORECEPTORS AND USE THEREOF FUJIFILM Cellular Dynamics, Inc. (US) 2026-04-16 — — US disclosed
US-20260027215-A1 COMPOSITIONS FOR TRANSPORT OF THERAPEUTIC CARGOS USING BINDERS TARGETING CA-IV RECEPTIVE BIO INC (US) 2026-01-29 — — US disclosed
EP-4070098-B1 LARGE SCALE ORGANOID ANALYSIS TEMPUS AI INC (US) 2025-12-24 — — EP disclosed
US-20250250540-A1 METHOD FOR DIFFERENTIATION OF OCULAR CELLS AND USE THEREOF FUJIFILM Cellular Dynamics, Inc. (US) 2025-08-07 — — US disclosed
US-20250243456-A1 METHOD FOR DIFFERENTIATION OF OCULAR CELLS AND USE THEREOF FUJIFILM Cellular Dynamics, Inc. (US) 2025-07-31 — — US disclosed
WO-2022258001-A1 COMPOUND AND METHOD FOR TREATING CHEMOTHERAPY-RELATED GASTROINTESTINAL SIDE EFFECTS 上海岸阔医药科技有限公司 2022-12-15 — — WO disclosed
US-20220323406-A1 METHODS AND COMPOSITIONS FOR DIFFERENTIATING STEM CELLS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-10-13 — — US disclosed
CN-108017630-B Preparation method of small-specific-surface-area palbociclib free base 上海创诺制药有限公司 2022-10-11 — — CN disclosed
US-20220280519-A1 COMBINATIONS OF AGENTS TO TREAT HEMATOLOGICAL MALIGNANCIES OREGON HEALTH & SCIENCE UNIVERSITY (US) 2022-09-08 — — US disclosed
US-11332467-B2 Solid state forms of palbociclib dimesylate PLANTEX LTD. (IL) 2022-05-17 — — US disclosed
CN-114181905-A Exosome easy to permeate blood brain barrier 南京中医药大学 2022-03-15 — — CN disclosed
CN-109729716-B PI3K inhibitor combination 拜耳制药股份公司 2022-03-15 — — CN 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 (5 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-11332467-B2 Solid state forms of palbociclib dimesylate CDK4, SETD1B, CDK3 CDK4 1/4885CCND1 171/4885CDK6 7/4885
US-20260103678-A1 BILAYER OF RETINAL PIGMENTED EPITHELIUM AND PHOTORECEPTORS AND USE THEREOF PAX2, ZP1, ALDH1A2 CDK4 2982/4885CCND1 2299/4885CDK6 3800/4885
US-20230183323-A1 METHODS FOR PREVENTING, REVERSING OR TREATING A COVID-19 INFECTION CHI3L1, CHI3L2, ACE2 CDK4 4545/4885CCND1 4876/4885CDK6 4683/4885
US-20260027215-A1 COMPOSITIONS FOR TRANSPORT OF THERAPEUTIC CARGOS USING BINDERS TARGETING CA-IV CA4, FLT4, CAMK4 CDK4 298/4885CCND1 3763/4885CDK6 640/4885
US-20220280519-A1 COMBINATIONS OF AGENTS TO TREAT HEMATOLOGICAL MALIGNANCIES MCL1, MPL, BCL9 CDK4 93/4885CCND1 544/4885CDK6 349/4885

“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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