SCHEMBL9211517

SCHEMBL9211517

CCOC(=O)C(=CNC1CC1)C(=O)c1cc(F)c(Cl)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.42
HPGD P15428 3/20 0.40
MAPT P10636 4/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
NPSR1 Q6W5P4 5/20 0.35
KDM4E B2RXH2 3/20 0.35
TDP1 Q9NUW8 1/20 0.35
MEN1 O00255 3/20 0.35
KMT2A Q03164 3/20 0.35
CYP1A2 P05177 2/20 0.35
CYP2C19 P33261 2/20 0.35
LMNA P02545 1/20 0.35
CYP2C9 P11712 1/20 0.35
TLR4 O00206 4/20 0.35
DHODH Q02127 1/20 0.34
RECQL P46063 1/20 0.34
ALDH1A1 P00352 1/20 0.33
NPY1R P25929 1/20 0.33

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
SCHEMBL9720579 1.00 GAA (0.42) GAAHPGDMAPTNPC1RAB9A
SCHEMBL29754269 1.00 GAA (0.42) GAAHPGDMAPTNPC1RAB9A
SCHEMBL9562462 1.00 GAA (0.42) GAAHPGDMAPTNPC1RAB9A
SCHEMBL5256942 0.94 GAA (0.48) GAAHPGDMAPTNPC1RAB9A
SCHEMBL9492350 0.94 GAA (0.48) GAAHPGDMAPTNPC1RAB9A
SCHEMBL10592860 0.94 GAA (0.48) GAAHPGDMAPTNPC1RAB9A
SCHEMBL29445577 0.90 HPGD (0.43) GAAHPGDMAPTNPC1RAB9A
SCHEMBL9489704 0.90 HPGD (0.43) GAAHPGDMAPTNPC1RAB9A
SCHEMBL9874727 0.90 HPGD (0.43) GAAHPGDMAPTNPC1RAB9A
SCHEMBL9627791 0.88 MAPT (0.36) GAAHPGDMAPTSMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114436875-B Preparation method of cyclopropylethyl amide 江苏飞宇医药科技股份有限公司 2023-05-12 CN disclosed
CN-114436875-A Preparation method of cyclopropylethyl amide 江苏飞宇医药科技股份有限公司 2022-05-06 CN disclosed
EP-0457090-B1 Process for the preparation of 3-amino-2 (het)aroyl-acrylic acid derivatives BAYER AG (DE) 1995-11-29 EP disclosed
US-5182401-A Bactericide intermediate BAYER AKTIENGESELLSCHAFT (DE) 1993-01-26 US disclosed
US-5169853-A Antibacterial agents; administering to mammals for infection STERLING DRUG INC. (US) 1992-12-08 US disclosed
US-5077429-A 7-AMINO-1-CYCLOPROPYL-4-OXO-1,4-DIHYDRO-QUINOLINE- AND NAPHTHYRIDINE-3-CARBOXYLIC ACIDS, PROCESSES FOR THEIR PREPARATION AND ANTIBACTERIAL AGENTS CONTAINING THESE COMPOUNDS BAYER AKTIENGESELLSCHAFT (DE) 1991-12-31 US disclosed
US-5075319-A Bactericides STERLING DRUG INC. (US) 1991-12-24 US disclosed
EP-0457090-A2 Process for the preparation of 3-amino-2 (het)aroyl-acrylic acid derivatives BAYER AG (DE) 1991-11-21 EP disclosed
EP-0176846-B1 3-AMINO-2-BENZOYL-ACRYLIC-ACID DERIVATIVES AND PROCESS FOR THEIR PREPARATION BAYER AG (DE) 1989-08-16 EP disclosed
US-4699992-A 3-amino-2-benzoylacrylic acid derivatives BAYER AKTIENGESELLSCHAFT (DE) 1987-10-13 US disclosed
US-4559341-A Quinolonecarboxylic acids and antibacterial agents containing these compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-12-17 US disclosed
US-4547503-A 1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-[4-(oxo-alkyl)-1-piperazinyl]quinoline-3-carboxylic acids and their derivatives, and antibacterial agents containing them BAYER AKTIENGESELLSCHAFT (DE) 1985-10-15 US disclosed
US-4544658-A FEED ADDITIVES BAYER AKTIENGESELLSCHAFT (DE) 1985-10-01 US disclosed
EP-0121727-A1 Bactericidal agent based on quinolonecarboxylic acids BAYER AG (DE) 1984-10-17 EP disclosed
EP-0118854-A1 Bactericidal agent containing quinolone-carboxylic acids BAYER AG (DE) 1984-09-19 EP disclosed
EP-0117473-A1 Quinolone carboxylic acids, process for their preparation and antibacterial compositions containing them BAYER AG (DE) 1984-09-05 EP disclosed
EP-0117474-A1 Quinolone carboxylic acids, process for their preparation and antibacterial compositions containing them BAYER AG (DE) 1984-09-05 EP disclosed
EP-0113093-A1 1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(alkyl-1-piperazinyl)-3-quinoline-carboxylic acids, process for their preparation and antibacterial agents containing them BAYER AG (DE) 1984-07-11 EP disclosed
EP-0113091-A1 Microbiocidal agents based on quinolone-carboxylic acids BAYER AG (DE) 1984-07-11 EP disclosed
EP-0113092-A1 1-Cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(4-(oxoalkyl)-1-piperazinyl)-3-quinoline-carboxylic acids and their derivatives, process for their preparation and antibacterial agents containing them BAYER AG (DE) 1984-07-11 EP disclosed