SCHEMBL446469

SCHEMBL446469

C[CH]OC(=O)CC(C)C

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL2445238 0.81
SCHEMBL4634291 0.81
SCHEMBL1486190 0.80
SCHEMBL2907462 0.78 MMP1 (0.42)
SCHEMBL207282 0.78
SCHEMBL448017 0.76 MMP1 (0.41)
SCHEMBL7597442 0.76 MMP1 (0.41)
SCHEMBL4393274 0.74
SCHEMBL127431 0.74 MMP1 (0.58)
SCHEMBL2980552 0.73 MMP1 (0.52)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2189443-B1 TRICYCLIC AMIDE COMPOUND RES FOUND ITSUU LAB (JP) 2013-10-23 EP claimed
EP-0497978-B1 CEPHALOSPORIN COMPOUNDS AND PRODUCTION THEREOF KYOTO PHARMA IND (JP) 1997-04-16 EP claimed
US-5389625-A Sweet taste; oral administering KYOTO PHARMACEUTICAL INDUSTRIES, LTD. (JP) 1995-02-14 US claimed
EP-0497978-A1 CEPHALOSPORIN COMPOUNDS AND PRODUCTION THEREOF Kyoto Pharmaceutical Industries, Ltd. (JP) 1992-08-12 EP claimed
US-4420478-A ANTIBIOTICS, BACTERICIDES, CEPHALOSPORINS ROUSSEL UCLAF (FR) 1983-12-13 US claimed
US-4287193-A ANTIBIOTIC DERIVATIVES OF CEPHALOSPORANIC ACID ROUSSEL UCLAF (FR) 1981-09-01 US claimed
US-4267320-A ESTERS OF A 7-/2-/FUR-2-YL/-2-METHOXYIMINOACETAMIDO DERIVATIVES; ORAL GLAXO LABORATORIES LIMITED (GB) 1981-05-12 US claimed
US-4198416-A 5-Alkoxy-picolinic esters and anti-hypertensive composition containing 5-alkoxy-picolinic esters MEIJI SEIKA KAISHA, LTD. (JP) 1980-04-15 US claimed
US-20240131180-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2024-04-25 US disclosed
EP-4025253-B1 DRUG ANTIBODY CONJUGATES PHARMA MAR SA (ES) 2024-03-20 EP disclosed
US-20230218774-A1 DRUG ANTIBODY CONJUGATES PHARMA MAR, S.A. (ES) 2023-07-13 US disclosed
EP-4138923-A1 DRUG ANTIBODY CONJUGATES Pharma Mar, S.A. (ES) 2023-03-01 EP disclosed
US-20230012681-A1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES PHARMA MAR, S.A. (ES) 2023-01-19 US disclosed
EP-3870234-B1 ANTIBODY DRUG CONJUGATES COMPRISING ECTEINASCIDIN DERIVATIVES PHARMA MAR SA (ES) 2022-12-21 EP disclosed
US-4374834-A CEPHEM ANTIBIOTICS Uclaf, Roussel (FR) 1983-02-22 US disclosed
US-4328225-A ANTIBIOTIC ROUSSEL UCLAF (FR) 1982-05-04 US disclosed
US-4287193-A ANTIBIOTIC DERIVATIVES OF CEPHALOSPORANIC ACID ROUSSEL UCLAF (FR) 1981-09-01 US disclosed
US-4267320-A ESTERS OF A 7-/2-/FUR-2-YL/-2-METHOXYIMINOACETAMIDO DERIVATIVES; ORAL GLAXO LABORATORIES LIMITED (GB) 1981-05-12 US disclosed
US-4198416-A 5-Alkoxy-picolinic esters and anti-hypertensive composition containing 5-alkoxy-picolinic esters MEIJI SEIKA KAISHA, LTD. (JP) 1980-04-15 US disclosed
US-4189489-A 5-Alkoxy-picolinic acid calcium salts and anti-hypertensive composition containing 5-alkoxy-picolinic acid calcium salts and anti-hypertensive composition thereof MEIJI SEIKA KAISHA, LTD. (JP) 1980-02-19 US disclosed