SCHEMBL452697

SCHEMBL452697

[CH2]COC(=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
SCHEMBL16996650 0.81 MMP1 (0.48)
SCHEMBL2445241 0.81
SCHEMBL4396014 0.81
SCHEMBL28422258 0.81
SCHEMBL2900644 0.81 MMP1 (0.41)
SCHEMBL22092055 0.81
SCHEMBL6007719 0.79 PRKCA (0.31)
SCHEMBL18378814 0.79 MMP1 (0.46)
SCHEMBL4198019 0.78 MMP1 (0.38)
SCHEMBL128660 0.77 TSHR (0.48)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0497978-B1 CEPHALOSPORIN COMPOUNDS AND PRODUCTION THEREOF KYOTO PHARMA IND (JP) 1997-04-16 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-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
CN-114615999-B Drug antibody conjugates 法马马有限公司 2024-03-08 CN 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-11591426-B2 Copolymer, wetting agent, medical device, and method for producing same TORAY INDUSTRIES, INC. (JP) 2023-02-28 US 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-4992431-A Bactericides or antibiotics ROUSSELUCLAF (FR) 1991-02-12 US disclosed
US-4908359-A Pharmaceuticals Uclaf, Roussel (FR) 1990-03-13 US disclosed
US-4476124-A ISOCEPHALOSPORIN ANTIBIOTICS ROUSSEL UCLAF (FR) 1984-10-09 US disclosed
US-4439433-A CEPHALOSPORIN ANTIBIOTICS ROUSSEL UCLAF (FR) 1984-03-27 US disclosed
US-4426519-A ANTIBIOTICS ROUSSEL UCLAF (FR) 1984-01-17 US disclosed
US-4420478-A ANTIBIOTICS, BACTERICIDES, CEPHALOSPORINS ROUSSEL UCLAF (FR) 1983-12-13 US 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