SCHEMBL9636141

SCHEMBL9636141

CCN1CCN(c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)CC1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.69
ALDH1A1 P00352 5/20 0.69
HPGD P15428 4/20 0.69
HSD17B10 Q99714 4/20 0.69
LMNA P02545 1/20 0.69
MAPT P10636 1/20 0.69
KCNH2 Q12809 5/20 0.58
TOP2A P11388 5/20 0.57
TOP2B Q02880 5/20 0.57
POLB P06746 2/20 0.56
OPRM1 P35372 2/20 0.56
CHRM2 P08172 1/20 0.56
CHRM1 P11229 1/20 0.56
OPRD1 P41143 1/20 0.56
PRKD3 O94806 1/20 0.54
ALOX15 P16050 1/20 0.54
CLK2 P49760 1/20 0.54
CLK4 Q9HAZ1 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
PMP22 Q01453 1/20 0.53

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
SCHEMBL10569538 0.92 KCNH2 (0.69) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL312188 0.91 ALDH1A1 (0.69) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL8433086 0.90 ALDH1A1 (0.61) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL10400672 0.90 KCNH2 (0.56) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL9473967 0.89 KDM4E (0.62) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL7821381 0.89 KDM4E (0.69) KDM4EALDH1A1HPGDHSD17B10KCNH2
SCHEMBL10736927 0.89 TOP2A (0.60) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL10809502 0.88 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL10785816 0.88 TOP2A (0.62) KDM4EALDH1A1HPGDHSD17B10LMNA
SCHEMBL9668066 0.88 TOP2A (0.62) KDM4EALDH1A1HPGDHSD17B10LMNA

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4556658-A 7-Amino-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-quinoline-3-carboxylic acids and antibacterial agents containing these compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-12-03 US claimed
EP-0337231-B1 I. M. INJECTION FORMS OF GYRASE-INHIBITORS BAYER AG (DE) 1992-06-17 EP disclosed
US-5023257-A Related to ciprofloxacin, in the form of oily suspension; bacterial infections BAYER AKTIENGESELLSCHAFT (DE) 1991-06-11 US disclosed
US-4952695-A Cyclopropyl-6,7,8-trifluoro-1,4-dihydro-4-oxo-3-quinoline carboxylic acid, intermediate for antibacterials BAYER AKTIENGESELLSCHAFT (DE) 1990-08-28 US disclosed
EP-0337231-A2 I. M. injection forms of gyrase-inhibitors BAYER AG (DE) 1989-10-18 EP disclosed
EP-0126355-B1 7-AMINO-1-CYCLOPROPYL-6,8-DIFLUORO-1,4-DIHYDRO-4-OXO-3-QUINOLINE-CARBOXYLIC ACID, PROCESSES FOR THEIR PREPARATION AND ANTIBACTERIAL AGENTS CONTAINING THEM BAYER AG (DE) 1987-09-09 EP disclosed
US-4556658-A 7-Amino-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-quinoline-3-carboxylic acids and antibacterial agents containing these compounds BAYER AKTIENGESELLSCHAFT (DE) 1985-12-03 US disclosed
EP-0126355-A1 7-Amino-1-cyclopropyl-6,8-difluoro-1,4-dihydro-4-oxo-3-quinoline-carboxylic acid, processes for their preparation and antibacterial agents containing them BAYER AG (DE) 1984-11-28 EP disclosed