SCHEMBL5197344

SCHEMBL5197344

C[C@H]1COc2c(C3(N)CC3)c(F)cc3c(=O)c(OC(=O)O)cn1c23

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.78
KMT2A Q03164 1/20 0.78
AADAT Q8N5Z0 2/20 0.50
ALDH1A1 P00352 5/20 0.49
TOP2A P11388 5/20 0.49
TOP2B Q02880 5/20 0.49
HPGD P15428 4/20 0.49
HSD17B10 Q99714 2/20 0.49
ALB P02768 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49
TUBB4A P04350 4/20 0.48
TUBB P07437 4/20 0.48
TUBA3C P0DPH7 4/20 0.48
TUBA1B P68363 4/20 0.48
TUBA4A P68366 4/20 0.48
TUBB4B P68371 4/20 0.48
TUBB3 Q13509 4/20 0.48
TUBB2A Q13885 4/20 0.48
TUBB8 Q3ZCM7 4/20 0.48
TUBA3E Q6PEY2 4/20 0.48

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
Pazufloxacin SCHEMBL21074686 0.87 KDM4E (1.00) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL34460 0.87 KDM4E (1.00) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL8386358 0.87 KDM4E (1.00) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL29381001 0.87 KDM4E (1.00) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL28659469 0.87 KDM4E (0.98) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL9873706 0.87 KDM4E (0.98) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL28087423 0.87 KDM4E (0.98) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL9872951 0.87 KDM4E (0.98) KDM4EKMT2AAADATALDH1A1TOP2A
Pazufloxacin SCHEMBL28064894 0.87 KDM4E (0.98) KDM4EKMT2AAADATALDH1A1TOP2A
SCHEMBL16518631 0.85 KDM4E (0.85) KDM4EKMT2AAADATALDH1A1TOP2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1408034-A1 Use of Quinoline derivatives as antibacterial agents Schulz & Schlimbach GbR (DE) 2004-04-14 EP claimed
EP-1244434-A2 USE OF CHEMOTHERAPEUTIC AGENTS Schulz, Hans-Herrmann (DE) 2002-10-02 EP claimed
WO-2001045679-A2 USE OF CHEMOTHERAPEUTIC AGENTS FOR TOPICAL TREATMENT SCHULZ HANS HERRMANN (DE) 2001-06-28 WO claimed
EP-1408034-B1 Use of Quinolone and Quinolizinone derivatives as chemotherapeutic agents SCHULZ & SCHLIMBACH GBR (DE) 2007-08-08 EP disclosed
EP-1408034-A1 Use of Quinoline derivatives as antibacterial agents Schulz & Schlimbach GbR (DE) 2004-04-14 EP disclosed
EP-1244434-A2 USE OF CHEMOTHERAPEUTIC AGENTS Schulz, Hans-Herrmann (DE) 2002-10-02 EP disclosed
WO-2001045679-A2 USE OF CHEMOTHERAPEUTIC AGENTS FOR TOPICAL TREATMENT SCHULZ HANS HERRMANN (DE) 2001-06-28 WO disclosed