Palbociclib

Palbociclib

SCHEMBL462630

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

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 1.00
CCND3 P30281 13/20 1.00
CCND2 P30279 12/20 1.00
CDK2 P24941 5/20 1.00
CCNA2 P20248 4/20 1.00
CCNA1 P78396 2/20 1.00
CDK9 P50750 2/20 1.00
CHEK1 O14757 1/20 1.00
DAPK3 O43293 1/20 1.00
CCNT1 O60563 1/20 1.00
CCNT2 O60583 1/20 1.00
ROCK2 O75116 1/20 1.00
STK16 O75716 1/20 1.00
CCNK O75909 1/20 1.00
PDE5A O76074 1/20 1.00
PRKD3 O94806 1/20 1.00
CCNB2 O95067 1/20 1.00
ABCB11 O95342 1/20 1.00

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 SCHEMBL29362383 1.00 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL30584526 1.00 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL29379411 1.00 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL29425547 0.99 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL29387795 0.99 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL2076416 0.99 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Palbociclib SCHEMBL28567292 0.98 CDK4 (0.97) CDK4CCND1CCND3CCND2CDK2
SCHEMBL30176561 0.98 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
SCHEMBL4827183 0.98 CDK4 (1.00) CDK4CCND1CCND3CCND2CDK2
Hydrochloric Acid SCHEMBL4828453 0.97 CDK4 (0.98) 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

Appears in 14771 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260144778-A1 REGIMENS OF ESTROGEN RECEPTOR ANTAGONISTS OLEMA PHARMACEUTICALS, INC. (US) 2026-05-28 US claimed
CN-122094689-A Combination therapy of diacylglycerol kinase (DGK) alpha inhibitors with other therapies 2026-05-26 CN claimed
CN-122081503-A Application of WWP1 as estrogen receptor positive breast cancer targeting biomarker 2026-05-26 CN claimed
CN-122084900-A Application of CXCL6 in prognosis prediction of small cell lung cancer immunotherapy 2026-05-26 CN claimed
CN-122075677-A GM-CSF loaded tumor cell vaccine and application thereof in preventing and treating liver cancer 2026-05-26 CN claimed
CN-122075716-A Medicine for treating tumor by combining recombinant oncolytic virus and small-molecule anticancer medicine 2026-05-26 CN claimed
CN-122070932-A Application of combination of decitabine and anti-HER 2 antibody in preparation of medicines for treating tumors 上海交通大学 2026-05-22 CN claimed
WO-2026105121-A1 ANTICANCER FORMULATIONS AND USES THEREOF INTRAGEL THERAPEUTICS LTD. (IL) 2026-05-21 WO claimed
WO-2026103886-A1 PHARMACEUTICAL COMPOSITION, KIT AND USE THEREOF 浙江扬厉医药技术有限公司 2026-05-21 WO claimed
CN-116999565-B Multiple small nucleic acid delivery system and multiple target vaccine 四川大学 2026-05-19 CN claimed
EP-1740184-A1 COMBINATIONS OF SIGNAL TRANSDUCTION INHIBITORS Pfizer Products Incorporated (US) 2007-01-10 EP claimed
EP-1648889-A1 ISETHIONATE SALT OF A SELECTIVE CDK4 INHIBITOR Warner-Lambert Company LLC (US) 2006-04-26 EP claimed
EP-1470124-B1 2-(PYRIDIN-2-YLAMINO)-PYRIDO 2,3-d]PYRIMIDIN-7-ONES WARNER LAMBERT CO (US) 2005-12-28 EP claimed
WO-2005094830-A1 COMBINATIONS OF SIGNAL TRANSDUCTION INHIBITORS PFIZER PRODUCTS INC. (US) 2005-10-13 WO claimed
US-20050222163-A1 Combinations of signal transduction inhibitors PFIZER INC 2005-10-06 US claimed
US-6936612-B2 2-(Pyridin-2-ylamino)-pyrido[2,3-d]pyrimidin-7-ones WARNER-LAMBERT COMPANY (US) 2005-08-30 US claimed
US-20050137214-A1 2-(Pyridin-2-ylamino)-pyrido [2,3-D]pyrimidin-7-ones WARNER-LAMBERT COMPANY 2005-06-23 US claimed
US-20050059670-A1 6-acetyl-8-cyclopentyl-5-methyl-2-(5-piperazin-1-yl-pyridin-2-ylamino)-8H-pyrido[2,3-d]pyrimidin-7-one, which is a preferential cyclin-dependent kinase 4 (CDK4) inhibitor, used for treating inflammation and cell proliferative diseases such as cancer and restenosis PFIZER INC 2005-03-17 US claimed
WO-2005005426-A1 ISETHIONATE SALT OF A SELECTIVE CDK4 INHIBITOR WARNER-LAMBERT COMPANY LLC (US) 2005-01-20 WO claimed
US-20030149001-A1 2-(Pyridin-2-ylamino)-pyrido[2,3-d]pyrimidin-7-ones BARVIAN MARK (US) 2003-08-07 US claimed