SCHEMBL6725548

SCHEMBL6725548

CCC(OC(=O)O)C(C)C

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.34
MMP2 P08253 1/20 0.34
MMP3 P08254 1/20 0.34
MMP9 P14780 1/20 0.34
MMP13 P45452 1/20 0.34
TSHR P16473 2/20 0.31
FFAR3 O14843 1/20 0.30
LMNA P02545 2/20 0.30
AKR1C3 P42330 1/20 0.30
AKR1C2 P52895 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
SCHEMBL27906528 0.87 FFAR3 (0.35) TSHRFFAR3
SCHEMBL4297066 0.83 ALDH1A1 (0.31)
SCHEMBL544721 0.83 TSHR (0.35) TSHR
SCHEMBL38662692 0.82 MMP1 (0.31) MMP1MMP2MMP3MMP9MMP13
SCHEMBL14693780 0.82 ALDH1A1 (0.33) MMP1MMP2MMP3MMP9MMP13
SCHEMBL29655977 0.81
SCHEMBL29026096 0.81 TSHR (0.33) TSHR
SCHEMBL38662455 0.81
SCHEMBL6725545 0.80 TSHR (0.31) MMP1MMP2MMP3MMP9MMP13
SCHEMBL1698005 0.80 TSHR (0.48) TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118712493-A Electrolyte and lithium ion battery 深圳市豪鹏科技股份有限公司 2024-09-27 CN claimed
CN-117080566-A Electrolyte, and electrochemical device and electronic device using same 宁德新能源科技有限公司 2023-11-17 CN claimed
CN-117039118-A Secondary battery and electronic device 宁德新能源科技有限公司 2023-11-10 CN claimed
CN-115362215-B Aqueous resin composition and coating agent DIC株式会社 2024-10-18 CN disclosed
CN-118712493-A Electrolyte and lithium ion battery 深圳市豪鹏科技股份有限公司 2024-09-27 CN disclosed
US-20240301114-A1 POLYCARBONATE DIOL AND PRODUCING METHOD THEREOF, AND POLYURETHANE AND ACTIVE ENERGY RAY-CURABLE POLYMER COMPOSITION BOTH FORMED USING SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2024-09-12 US disclosed
CN-117580916-A Binder resin composition for aqueous inkjet ink, and printed layer DIC株式会社 2024-02-20 CN disclosed
EP-3560981-B1 POLYCARBONATE POLYOL AND POLYURETHANE MITSUBISHI CHEM CORP (JP) 2024-01-31 EP disclosed
CN-117467106-A Urethane resin composition and urethane resin molded article using same DIC株式会社 2024-01-30 CN disclosed
CN-117276812-A Electrochemical device and electronic device 宁德新能源科技有限公司 2023-12-22 CN disclosed
CN-117164839-A Transesterification catalyst, method for producing polycarbonate diol, and polycarbonate diol 旭化成株式会社 2023-12-05 CN disclosed
EP-0625976-A1 MIXTURES OF OPTICALLY ACTIVE CYCLOHEXENONE OXIME ETHERS, PROCESS AND INTERMEDIATE PRODUCTS FOR THEIR PRODUCTION AND THEIR USE AS HERBICIDES. BASF AG (DE) 1994-11-30 EP disclosed
EP-0625975-A1 CYCLOHEXENONE OXIME ETHERS, PROCESS FOR MAKING THEM AND THEIR USE AS HERBICIDES. BASF AG (DE) 1994-11-30 EP disclosed
EP-0625974-A1 MIXTURES OF OPTICALLY ACTIVE CYCLOHEXENONE OXIME ETHERS, PROCESS AND INTERMEDIATE PRODUCTS FOR THEIR PRODUCTION AND THEIR USE AS HERBICIDES BASF Aktiengesellschaft (DE) 1994-11-30 EP disclosed
WO-1994004489-A1 CYCLOHEXENONOXIME ETHERS, THEIR PREPARATION AND THEIR USE BASF AKTIENGESELLSCHAFT (DE) 1994-03-03 WO disclosed
WO-1993024456-A1 SUBSTITUTED ISOINDOLONES BASF AKTIENGESELLSCHAFT (DE) 1993-12-09 WO disclosed
WO-1993016063-A1 CYCLOHEXENONE OXIME ETHERS, PROCESS FOR MAKING THEM AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-08-19 WO disclosed
WO-1993016062-A1 MIXTURES OF OPTICALLY ACTIVE CYCLOHEXENONE OXIME ETHERS, PROCESS AND INTERMEDIATE PRODUCTS FOR THEIR PRODUCTION AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-08-19 WO disclosed
WO-1993016061-A1 MIXTURES OF OPTICALLY ACTIVE CYCLOHEXENONE OXIME ETHERS, PROCESS AND INTERMEDIATE PRODUCTS FOR THEIR PRODUCTION AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-08-19 WO disclosed
WO-1993016033-A1 CYCLOHEXENONE OXIME ETHERS, METHODS OF PREPARING THEM AND THEIR USE AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 1993-08-19 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 (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-20240301114-A1 POLYCARBONATE DIOL AND PRODUCING METHOD THEREOF, AND POLYURETHANE AND ACTIVE ENERGY RAY-CURABLE POLYMER COMPOSITION BOTH FORMED USING SAME DIMT1, CAD, PUF60 MMP1 2749/4885MMP2 2798/4885MMP3 2491/4885

“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.