SCHEMBL648799

SCHEMBL648799

CCCCOC(=O)CC(=O)CC

nearest known ligand 0.61

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FAAH O00519 2/20 0.61
NAAA Q02083 1/20 0.57
ALDH1A1 P00352 1/20 0.52
ATM Q13315 1/20 0.48
DGKA P23743 1/20 0.47
HTR2C P28335 1/20 0.46
TSHR P16473 2/20 0.45
HPGD P15428 1/20 0.45
RAD52 P43351 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
EPHX1 P07099 1/20 0.44
ACHE P22303 6/20 0.42
HCAR2 Q8TDS4 1/20 0.42
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL29467312 1.00 FAAH (0.61) FAAHNAAAALDH1A1ATMDGKA
SCHEMBL27939809 0.98 FAAH (0.59) FAAHNAAAALDH1A1ATMDGKA
SCHEMBL10524903 0.96 FAAH (0.58) FAAHNAAAALDH1A1ATMDGKA
SCHEMBL10603195 0.94 FAAH (0.70) FAAHNAAAALDH1A1DGKAHTR2C
SCHEMBL10604360 0.92 FAAH (0.73) FAAHNAAADGKAHTR2CTSHR
SCHEMBL8602516 0.92 FAAH (0.73) FAAHNAAADGKAHTR2CTSHR
SCHEMBL10604950 0.92 FAAH (0.73) FAAHNAAADGKAHTR2CTSHR
SCHEMBL10901480 0.92 FAAH (0.73) FAAHNAAADGKAHTR2CTSHR
SCHEMBL1010990 0.91 FAAH (0.66) FAAHNAAAALDH1A1ATMDGKA
SCHEMBL6669031 0.86 FAAH (0.50) FAAHNAAAALDH1A1DGKAHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118638002-A Preparation method of sodium valproate toxic metabolite 2-propyl-4-pentenoic acid 湖南大学 2024-09-13 CN claimed
CN-116947600-B Preparation method of 2-isopropyl valeric acid as valproic acid process impurity 湖南省湘中制药有限公司 2024-04-26 CN claimed
CN-116874347-B Preparation method of impurity dipropylvaleric acid in valproic acid process 湖南省湘中制药有限公司 2024-03-29 CN claimed
CN-116947600-A Preparation method of 2-isopropyl valeric acid as valproic acid process impurity 湖南省湘中制药有限公司 2023-10-27 CN claimed
CN-116874347-A Preparation method of impurity dipropylvaleric acid in valproic acid process 湖南省湘中制药有限公司 2023-10-13 CN claimed
CN-107876092-B Application of titanium catalyst with cyclic structure as reaction catalyst for synthesizing benzyl carbonate or diphenyl carbonate by ester exchange 华东理工大学 2023-01-10 CN claimed
EP-4069792-A1 MICHAEL REACTION-CURING HYBRID SYSTEM FOR USE IN CHEMICAL FASTENING TECHNOLOGY fischerwerke GmbH & Co. KG (DE) 2022-10-12 EP claimed
CN-114729253-A Michael addition hardening synthetic resin for chemical fixing technology 费希尔厂有限责任两合公司 2022-07-08 CN claimed
CN-114729224-A Michael addition hardening hybrid system for chemical fixation technology 费希尔厂有限责任两合公司 2022-07-08 CN claimed
WO-2021110621-A1 MICHAEL REACTION-CURING HYBRID SYSTEM FOR USE IN CHEMICAL FASTENING TECHNOLOGY FISCHERWERKE GMBH & CO. KG (DE) 2021-06-10 WO claimed
CN-101657759-B Alkali-developable photosensitive resin composition and beta-diketone ADEKA CORP 2012-07-25 CN claimed
CN-114423758-B Antibacterial compounds 爱尔兰詹森科学公司 2025-05-27 CN disclosed
CN-118638002-A Preparation method of sodium valproate toxic metabolite 2-propyl-4-pentenoic acid 湖南大学 2024-09-13 CN disclosed
US-20240199611-A1 ANTIBACTERIAL COMPOUNDS Janssen Sciences Ireland Unlimited Company (IE) 2024-06-20 US disclosed
CN-116947600-B Preparation method of 2-isopropyl valeric acid as valproic acid process impurity 湖南省湘中制药有限公司 2024-04-26 CN disclosed
US-4188395-A 1,4-Dihydropyridine derivatives substituted in the 2 position, and their use as medicaments BAYER AKTIENGESELLSCHAFT (DE) 1980-02-12 US disclosed
US-4081596-A DIURETIC, SALURETIC, ANTIHYPERTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1978-03-28 US disclosed
US-4005215-A DIURETIC BAYER AKTIENGESELLSCHAFT (DT) 1977-01-25 US disclosed
US-3978077-A DIURETIC, HYPOTENSIVE, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (GB) 1976-08-31 US disclosed
US-3957814-A DIURETICS, SALURETICS, HYPOTENSIVE AGENTS, ANTITHROMBOTIC BAYER AKTIENGESELLSCHAFT (DT) 1976-05-18 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 (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-20240199611-A1 ANTIBACTERIAL COMPOUNDS FDPS, MT-ND4, NDUFS3 FAAH 4420/4885NAAA 1056/4885ALDH1A1 1644/4885

“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.