SCHEMBL29403292

SCHEMBL29403292

Cc1nc2c(F)cc(B3OC(C)(C)C(C)(C)O3)cc2n1C(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 14/20 0.36
CDK1 P06493 12/20 0.36
CDK6 Q00534 9/20 0.36
PLK4 O00444 3/20 0.35
IRAK4 Q9NWZ3 1/20 0.35
CDK2 P24941 3/20 0.35
CCNB1 P14635 3/20 0.34
CCNA2 P20248 2/20 0.34
CCND3 P30281 2/20 0.34
KDR P35968 2/20 0.34
CCNE1 P24864 2/20 0.34
CIT O14578 1/20 0.34
GAK O14976 1/20 0.34
DYRK3 O43781 1/20 0.34
CCNT1 O60563 1/20 0.34
STK16 O75716 1/20 0.34
CCNK O75909 1/20 0.34
STK10 O94804 1/20 0.34
PRKD3 O94806 1/20 0.34
ABCB11 O95342 1/20 0.34

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
SCHEMBL2511865 1.00 CDK4 (0.36) CDK4CDK1CDK6PLK4IRAK4
SCHEMBL18288741 0.88 CDK4 (0.36) CDK4CDK1CDK6IRAK4CDK2
SCHEMBL22272299 0.87 IRAK4 (0.36) IRAK4LPLLIPG
SCHEMBL30926519 0.84 LPL (0.31) IRAK4LPLLIPG
SCHEMBL21522780 0.84 CDK4 (0.40) CDK4CDK6IRAK4CCND3CCND1
SCHEMBL21522812 0.84 CDK4 (0.40) CDK4CDK6IRAK4CCND3CCND1
SCHEMBL21522778 0.84 CDK4 (0.40) CDK4CDK6IRAK4CCND3CCND1
SCHEMBL20987201 0.84 LPL (0.31) IRAK4EGFRLPLLIPG
SCHEMBL22172152 0.84 KMT2A (0.33) CDK4CDK6IRAK4CCND3CCND1
SCHEMBL19836734 0.84 ROCK1 (0.32) CDK4CDK6IRAK4CCND3CCND1

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4626423-A1 CDK INHIBITORS AND METHODS AND USE THEREOF Relay Therapeutics, Inc. (US) 2025-10-08 EP disclosed
EP-4592286-A1 MACROCYCLIC NITROGEN-CONTAINING CROWN ETHER COMPOUND AND USE THEREOF AS PROTEIN KINASE INHIBITOR Artivila Biopharma (CN) 2025-07-30 EP disclosed
EP-4565588-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF Suzhou Keen Therapeutics Co., Ltd. (CN) 2025-06-11 EP disclosed
WO-2024256569-A1 NOVEL CDK DEGRADERS RIJKSUNIVERSITEIT GRONINGEN (NL) 2024-12-19 WO disclosed
US-20240408169-A1 CYCLIN INHIBITORS CIRCLE PHARMA, INC. 2024-12-12 US disclosed
WO-2024220866-A1 NOVEL AMINOPYRIMIDINE DERIVATIVES AS CYCLIN-DEPENDENT KINASE INHIBITORS ACCUTAR BIOTECHNOLOGY INC. (US) 2024-10-24 WO disclosed
WO-2024173646-A1 CYCLIN-DEPENDENT KINASE DEGRADING COMPOUNDS INNOVO THERAPEUTICS, INC. (US) 2024-08-22 WO disclosed
WO-2024119122-A1 CDK INHIBITORS AND METHODS AND USE THEREOF RELAY THERAPEUTICS, INC. (US) 2024-06-06 WO disclosed
WO-2023241620-A1 BIOLOGICALLY ACTIVE COMPOUNDS AND METHODS THEREOF SUZHOU KEEN THERAPEUTICS CO., LTD. (CN) 2023-12-21 WO disclosed
EP-3492462-B1 AMINO PYRIMIDINE COMPOUND FOR INHIBITING PROTEIN TYROSINE KINASE ACTIVITY SHENZHEN TARGETRX INC (CN) 2023-08-30 EP disclosed
CN-115057845-A Preparation method of Abelide 山东罗欣药业集团恒欣药业有限公司 2022-09-16 CN disclosed
WO-2022166916-A1 SUBSTITUTED HETEROARYL DERIVATIVE, AND COMPOSITION AND USE THEREOF 深圳市塔吉瑞生物医药有限公司 2022-08-11 WO disclosed
CN-114874189-A Substituted heteroaryl derivatives, compositions and uses thereof 深圳市塔吉瑞生物医药有限公司 2022-08-09 CN disclosed
CN-112225724-B Benzimidazole compound kinase inhibitor and preparation method and application thereof 江苏豪森药业集团有限公司 2022-04-29 CN disclosed
CN-112250669-B Benzimidazole compound kinase inhibitor and preparation method and application thereof 江苏豪森药业集团有限公司 2022-02-25 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 (1 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-20240408169-A1 CYCLIN INHIBITORS CCNI, CDK2, CDK1 CDK4 7/4885CDK1 3/4885CDK6 19/4885

“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.