SCHEMBL9844577

SCHEMBL9844577

O=C(O)c1cn(C2CC2)c2cc(Cl)c(Cl)cc2c1=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.56
ALDH1A1 P00352 5/20 0.56
LMNA P02545 3/20 0.56
TOP2A P11388 3/20 0.56
TOP2B Q02880 3/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 2/20 0.56
CYP1A2 P05177 2/20 0.56
CYP2C9 P11712 1/20 0.56
MAPT P10636 1/20 0.53
PIK3CG P48736 4/20 0.50
PIK3CD O00329 3/20 0.50
PIK3R1 P27986 3/20 0.50
PIK3CA P42336 3/20 0.50
POLB P06746 1/20 0.46
CHRM2 P08172 1/20 0.46
CHRM1 P11229 1/20 0.46
OPRM1 P35372 1/20 0.46
OPRD1 P41143 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.46

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
SCHEMBL13497296 0.89 KDM4E (0.52) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL10625961 0.89 KDM4E (0.53) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL10627016 0.89 KDM4E (0.53) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL10874188 0.89 KDM4E (0.52) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL2108243 0.89 ALDH1A1 (0.64) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL4718738 0.89 KDM4E (0.60) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL541544 0.88 ALDH1A1 (0.62) KDM4EALDH1A1LMNATOP2ATOP2B
SCHEMBL541543 0.88 ALDH1A1 (0.62) KDM4EALDH1A1LMNATOP2ATOP2B
Hydrochloric Acid SCHEMBL28459278 0.88 ALDH1A1 (0.62) KDM4EALDH1A1LMNATOP2ATOP2B
Oxalic Acid SCHEMBL27745929 0.86 ALDH1A1 (0.60) KDM4EALDH1A1LMNATOP2ATOP2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109912504-B Quinoline carboxylic acid compound and preparation method and application thereof 山东省联合农药工业有限公司 2020-11-10 CN disclosed
WO-2020199980-A1 QUINOLINE CARBOXYLIC ACID COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 山东省联合农药工业有限公司 2020-10-08 WO disclosed
EP-0429304-A2 Pyridone-carboxylic acid derivatives and their use as veterinary medicines SHIONOGI SEIYAKU KABUSHIKI KAISHA trading under the name of SHIONOGI & CO. LTD. (JP) 1991-05-29 EP disclosed
US-4777175-A (NAPHTHYRIDINE, QUINOLINE) CARBOXYLIC ACID WARNER-LAMBERT COMPANY (US) 1988-10-11 US disclosed
US-4771054-A QUINOLINE CARBOXYLIC ACID WARNER-LAMBERT COMPANY (US) 1988-09-13 US disclosed
EP-0230274-A2 Derivatives of 7-(azabicycloalkyl)-quinoloncarboxylic acid and -naphthyridoncarboxylic acid BAYER AG (DE) 1987-07-29 EP disclosed
US-4665079-A QUINOLINE DERIVATIVES WARNER-LAMBERT COMPANY (US) 1987-05-12 US disclosed
EP-0117473-B1 QUINOLONE CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION AND ANTIBACTERIAL COMPOSITIONS CONTAINING THEM BAYER AG (DE) 1987-01-28 EP disclosed
US-4638067-A NAPHTHYRIDINE AND QUINOLINE CARBOXYLIC ACIDS WARNER-LAMBERT CO. (US) 1987-01-20 US disclosed
EP-0117474-B1 QUINOLONE CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION AND ANTIBACTERIAL COMPOSITIONS CONTAINING THEM BAYER AG (DE) 1986-10-29 EP disclosed
EP-0168733-A2 Process for the preparation of quinolinone and naphthyridoncarboxylic acids BAYER AG (DE) 1986-01-22 EP disclosed
US-4563459-A FUNGICIDES AND BACTERICIDES FOR AGRICULTURAL USE BAYER AKTIENGESELLSCHAFT (DE) 1986-01-07 US disclosed
US-4563448-A PHYTOPATHOGENS BAYER AKTIENGESELLSCHAFT (DE) 1986-01-07 US disclosed
US-4559341-A Quinolonecarboxylic acids and antibacterial agents containing these compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-12-17 US disclosed
US-4559342-A Quinolone acids and antibacterial agents containing these compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-12-17 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-0113091-A1 Microbiocidal agents based on quinolone-carboxylic acids BAYER AG (DE) 1984-07-11 EP disclosed