SCHEMBL3717262

SCHEMBL3717262

CCCCCC(C)(C)C(N)=O

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
FDPS P14324 8/20 0.45
SMPD1 P17405 2/20 0.43
CES2 O00748 2/20 0.43
GGPS1 O95749 4/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
CES1 P23141 1/20 0.40

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
SCHEMBL31448016 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL310552 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL3969522 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL75740 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL31447926 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL373955 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL547320 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL7104154 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL2351092 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1
SCHEMBL31447903 0.98 FDPS (0.47) FDPSSMPD1CES2GGPS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025233452-A1 CROP PROTECTION COMPOSITIONS WITH AMIDE/GVL SOLVENT SYSTEM BASF SE (DE) 2025-11-13 WO claimed
WO-2025093527-A1 AN EMULSIFIABLE CONCENTRATE HAVING AN AMIDE/ESTER/CO-SOLVENT SOLVENT SYSTEM BASF SE (DE) 2025-05-08 WO claimed
WO-2025242698-A1 AN OIL-IN-WATER EMULSION-BASED AGROCHEMICAL FORMULATION BASF SE (DE) 2025-11-27 WO disclosed
WO-2025233452-A1 CROP PROTECTION COMPOSITIONS WITH AMIDE/GVL SOLVENT SYSTEM BASF SE (DE) 2025-11-13 WO disclosed
WO-2025233453-A1 NEW AGROCHEMICAL FORMULATIONS BASF SE (DE) 2025-11-13 WO disclosed
WO-2025093527-A1 AN EMULSIFIABLE CONCENTRATE HAVING AN AMIDE/ESTER/CO-SOLVENT SOLVENT SYSTEM BASF SE (DE) 2025-05-08 WO disclosed
EP-4269385-A1 IONIZABLE LIPID COMPOUNDS Beijing Jitai Pharmaceutical Technology Co., Ltd. (CN) 2023-11-01 EP disclosed
CN-114716453-A Macrocyclization reactions and intermediates useful in the synthesis of analogs of halichondrin B 卫材R&D管理有限公司 2022-07-08 CN disclosed
CN-109942560-B Macrocyclization reactions and intermediates useful in the synthesis of analogs of halichondrin B 卫材R&D管理有限公司 2022-06-17 CN disclosed
CN-110115365-A The adjusting that actinism receptor and relative ligand are carried out 西诺米克斯公司 2019-08-13 CN disclosed
CN-101779124-B Modulation of chemosensory receptors and ligands associated therewith 西诺米克斯公司 2017-12-12 CN disclosed
US-20140357642-A1 IP receptor agonist heterocyclic compounds NOVARTIS AG (CH) 2014-12-04 US disclosed
CN-102001961-B Method for synthesizing amide lanthanum complexes and application thereof in preparation of high-K material precursor UNIV NANJING AERONAUTICS 2013-10-23 CN disclosed
CN-102060865-B Synthesis method of amide gadolinium complexes and application of gadolinium complexes in preparation of high-K material precursor UNIV NANJING AERONAUTICS 2013-04-24 CN disclosed
US-8399418-B2 Monosebacate of pyrazole derivative KISSEI PHARMACEUTICAL CO., LTD. (JP) 2013-03-19 US disclosed
US-8354382-B2 Hemifumarate of a pyrazole derivative KISSEI PHARMACEUTICAL CO., LTD. (JP) 2013-01-15 US disclosed
CN-102060865-A Synthesis method of amide gadolinium complexes and application of gadolinium complexes in preparation of high-K material precursor UNIV NANJING AERONAUTICS 2011-05-18 CN disclosed
CN-102001961-A Method for synthesizing amide lanthanum complexes and application thereof in preparation of high-K material precursor UNIV NANJING AERONAUTICS 2011-04-06 CN disclosed
US-20110034679-A1 HEMIFUMARATE OF A PYRAZOLE DERIVATIVE KISSEI PHARMACEUTICAL CO., LTD (JP) 2011-02-10 US disclosed
WO-2010132871-A1 THERMALLY STABLE VOLATILE FILM PRECURSORS WAYNE STATE UNIVERSITY (US) 2010-11-18 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-20110034679-A1 HEMIFUMARATE OF A PYRAZOLE DERIVATIVE UGDH, GCK, HPD FDPS 84/4885SMPD1 2423/4885CES2 4064/4885
US-20140357642-A1 IP receptor agonist heterocyclic compounds PTGIR, GPR68, GPR84 FDPS 1125/4885SMPD1 2038/4885CES2 4679/4885

“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.