SCHEMBL22208201

SCHEMBL22208201

COC(=O)C1(CCCCl)CCCN1

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 2/20 0.44
ARG2 P78540 1/20 0.44
CYP2D6 P10635 8/20 0.37
SLC6A2 P23975 8/20 0.37
SLC6A4 P31645 8/20 0.37
SLC6A3 Q01959 8/20 0.37
KCNH2 Q12809 2/20 0.37
CYP4F2 P78329 1/20 0.37
CYP4A11 Q02928 1/20 0.37
NPSR1 Q6W5P4 1/20 0.33

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
Hydrochloric Acid SCHEMBL31527327 0.90 ARG1 (0.40) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL15012107 0.81 CYP4F2 (0.44) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL26694474 0.80 ARG1 (0.40) ARG1ARG2CYP2D6SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL11652154 0.80 CYP2D6 (0.48) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL25329101 0.78 CYP4F2 (0.33) CYP4F2CYP4A11
SCHEMBL15567482 0.78 ARG1 (0.39) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL23053580 0.78 ARG1 (0.39) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL5928282 0.78 ARG1 (0.39) ARG1ARG2CYP2D6SLC6A2SLC6A4
SCHEMBL12909915 0.77 ARG1 (0.38) ARG1ARG2CYP2D6SLC6A2SLC6A4
Hydrochloric Acid SCHEMBL26120445 0.76 CYP4F2 (0.33) CYP4F2CYP4A11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4709729-A1 PYRAZOLO[4,3-F]QUINAZOLINE DERIVATIVES AS MODULATORS OF G12D MUTANT KRAS USEFUL FOR THE TREATMENT OF CANCER Jazz Pharmaceuticals Ireland Ltd. (IE) 2026-03-18 EP disclosed
WO-2024236452-A1 PYRAZOLO[4,3-F]QUINAZOLINE DERIVATIVES AS MODULATORS OF G12D MUTANT KRAS USEFUL FOR THE TREATMENT OF CANCER JAZZ PHARMACEUTICALS IRELAND LTD. (IE) 2024-11-21 WO disclosed
EP-4352061-A1 QUINAZOLINE DERIVATIVES USEFUL AS RAS INHIBITIORS Redx Pharma Plc (GB) 2024-04-17 EP disclosed
EP-4347589-A2 PYRIDO[4,3-D]PYRIMIDINE COMPOUNDS CAPABLE OF INHIBITING KRAS MUTANT PROTEINS Redx Pharma Plc (GB) 2024-04-10 EP disclosed
US-20240109893-A1 PREPARATION AND APPLICATION METHOD OF HETEROCYCLIC COMPOUNDS AS KRAS INHIBITOR SHANGHAI KECHOW PHARMA, INC. (CN) 2024-04-04 US disclosed
CN-117460730-A Pyrido [4,3-D ] pyrimidine compounds capable of inhibiting KRAS muteins 莱德克斯制药公共有限公司 2024-01-26 CN disclosed
CN-117425658-A Quinazoline derivatives as RAS inhibitors 莱德克斯制药公共有限公司 2024-01-19 CN disclosed
EP-4269405-A1 PREPARATION AND APPLICATION METHOD OF HETEROCYCLIC COMPOUND AS KRAS INHIBITOR Shanghai Kechow Pharma, Inc. (CN) 2023-11-01 EP disclosed
EP-4269405-A1 PREPARATION AND APPLICATION METHOD OF HETEROCYCLIC COMPOUND AS KRAS INHIBITOR Shanghai Kechow Pharma, Inc. (CN) 2023-11-01 EP disclosed
CN-116648452-A Preparation of heterocyclic compounds as KRAS inhibitors and methods of use thereof 上海科州药物研发有限公司 2023-08-25 CN disclosed
WO-2022258974-A1 QUINAZOLINE DERIVATIVES USEFUL AS RAS INHIBITIORS REDX PHARMA PLC (GB) 2022-12-15 WO disclosed
WO-2022248885-A2 COMPOUNDS REDX PHARMA PLC. (GB) 2022-12-01 WO disclosed
EP-4087573-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2022-11-16 EP disclosed
WO-2022170947-A1 TETRAHYDRONAPHTHYRIDINE DERIVATIVES AS KRAS MUTANT G12C INHIBITORS, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF 苏州阿尔脉生物科技有限公司 2022-08-18 WO disclosed
WO-2022135470-A1 PREPARATION AND APPLICATION METHOD OF HETEROCYCLIC COMPOUND AS KRAS INHIBITOR 上海科州药物研发有限公司 2022-06-30 WO disclosed
WO-2022135470-A1 PREPARATION AND APPLICATION METHOD OF HETEROCYCLIC COMPOUND AS KRAS INHIBITOR 上海科州药物研发有限公司 2022-06-30 WO disclosed
CN-113999226-A Heterocyclic compounds as KRAS inhibitors and methods of use thereof 上海科州药物研发有限公司 2022-02-01 CN disclosed
EP-3908283-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2021-11-17 EP disclosed
US-20200331911-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. 2020-10-22 US disclosed
WO-2020146613-A1 KRAS G12C INHIBITORS Mirati Therapeutics, Inc. (US) 2020-07-16 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 (2 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-20240109893-A1 PREPARATION AND APPLICATION METHOD OF HETEROCYCLIC COMPOUNDS AS KRAS INHIBITOR KRAS, NRAS, HRAS ARG1 3923/4885ARG2 4593/4885CYP2D6 896/4885
US-20200331911-A1 KRAS G12C INHIBITORS KRAS, NRAS, HRAS ARG1 4028/4885ARG2 4472/4885CYP2D6 3803/4885

“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.