SCHEMBL2429027

SCHEMBL2429027

O=C([O-])C1(C(=O)[O-])CCCCC1.[Ca+2]

nearest known ligand 0.41

Known targets — ChEMBL curated mechanism

GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 1/20 0.32
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
CYP1A2 P05177 1/20 0.30
TSHR P16473 1/20 0.30
BLM P54132 1/20 0.30
CACNA2D1 P54289 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
Water SCHEMBL30107704 0.97 CYP2C19 (0.31) CYP2C19ALDH1A1
SCHEMBL28968487 0.97
SCHEMBL28968537 0.94 CYP2C19 (0.32) CYP2C19USP2ALDH1A1LMNACYP1A2
SCHEMBL21295181 0.94 CYP2C19 (0.32) CYP2C19USP2ALDH1A1LMNACYP1A2
Zinc Ion SCHEMBL28968544 0.94 CYP2C19 (0.32) CYP2C19USP2ALDH1A1LMNACYP1A2
SCHEMBL6662738 0.94 TSHR (0.35) CYP2C19USP2ALDH1A1LMNACYP1A2
SCHEMBL8612559 0.94 CYP2C19 (0.32) CYP2C19USP2ALDH1A1LMNACYP1A2
Silver SCHEMBL21295179 0.94 CYP2C19 (0.32) CYP2C19USP2ALDH1A1LMNACYP1A2
Lithium Ion SCHEMBL28968511 0.94 CYP2C19 (0.32) CYP2C19USP2ALDH1A1LMNACYP1A2
SCHEMBL28968493 0.94 CYP2C19 (0.32) CYP2C19USP2ALDH1A1LMNACYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115785523-B Composition and application of alpha/beta composite nucleating agent for regulating and controlling mechanical properties of polypropylene 华东理工大学 2023-10-10 CN claimed
EP-3293212-B1 POLYMER COMPOSITION FOR CONTAINER CLOSURES THAI POLYETHYLENE CO LTD (TH) 2023-02-22 EP claimed
CN-115697700-A Oriented polyethylene film and articles comprising the same 陶氏环球技术有限责任公司 2023-02-03 CN claimed
CN-115232353-A Low-odor scratch-resistant polypropylene composition, expanded beads, preparation method of expanded beads and polypropylene expanded bead forming body 中国石油化工股份有限公司 2022-10-25 CN claimed
CN-114800985-A Rotational molding cross-linked polyethylene hand die and composition and preparation method thereof 安徽锐途新材料科技有限公司 2022-07-29 CN claimed
CN-109486426-B White-fog-proof and blue-light-proof hot-melt optical adhesive and preparation method thereof 广州市隆创新材料有限公司 2021-05-18 CN claimed
CN-103497405-A Nucleated master batch for improving production speed of polyethylene bottle cap NANJING KING TECH CHINA CO LTD 2014-01-08 CN claimed
WO-2014000820-A1 INSULATING COMPOSITION FOR ELECTRICAL POWER APPLICATIONS ABB RESEARCH LTD (CH) 2014-01-03 WO claimed
US-8026305-B2 Articles formed from nucleated polyethylene FINA TECHNOLOGY INC (US) 2011-09-27 US claimed
US-12600846-B2 Polymeric substrate including a barrier layer INV POLYPROPYLENE, LLC (US) 2026-04-14 US disclosed
US-12576620-B2 Modification of polypropylene resins with nucleating agents to enhance mechanical and barrier properties of films Superior Plastics Extrusion Co. Inc. (US) 2026-03-17 US disclosed
EP-4031370-B1 STAND UP POUCH WITH RECYCLED POLYETHYLENE NOVA CHEMICALS INTERNATIONAL SA (CH) 2026-02-25 EP disclosed
US-12491705-B2 Stand up pouch with recycled polyethylene NOVA CHEMICALS (INTERNATIONAL) S.A. (CH) 2025-12-09 US disclosed
US-20250223409-A1 Process of Preparing Masterbatch Compositions and Their Use MILLIKEN & COMPANY 2025-07-10 US disclosed
CN-103497405-A Nucleated master batch for improving production speed of polyethylene bottle cap NANJING KING TECH CHINA CO LTD 2014-01-08 CN disclosed
WO-2014000820-A1 INSULATING COMPOSITION FOR ELECTRICAL POWER APPLICATIONS ABB RESEARCH LTD (CH) 2014-01-03 WO disclosed
EP-2497453-A1 PLASTIC FILM HAVING OXYGEN ABSORBING FUNCTION AND INFUSION BAG Hosokawa Yoko Co., Ltd. (JP) 2012-09-12 EP disclosed
EP-2492092-A1 PLASTIC FILM AND INFUSION BAG Hosokawa Yoko Co., Ltd. (JP) 2012-08-29 EP disclosed
US-20120215196-A1 PLASTIC FILM HAVING OXYGEN ABSORBING FUNCTION AND INFUSION BAG HOSOKAWA YOKO CO., LTD. (JP) 2012-08-23 US disclosed
US-20120201984-A1 PLASTIC FILM AND INFUSION BAG HOSOKAWA YOKO CO., LTD. (JP) 2012-08-09 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 (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-12576620-B2 Modification of polypropylene resins with nucleating agents to enhance mechanical and barrier properties of films NUP93, HNRNPH1, NXF1 CYP2C19 3995/4885USP2 1581/4885ALDH1A1 3775/4885
US-12600846-B2 Polymeric substrate including a barrier layer ROS1, P4HTM, AHR CYP2C19 995/4885USP2 2114/4885ALDH1A1 1567/4885

“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.