SCHEMBL5546381

SCHEMBL5546381

O=C(O)c1cn(C2CC2)c2cc(N3CCNCC3)ccc2c1=O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.67
ALDH1A1 P00352 7/20 0.67
LMNA P02545 5/20 0.67
HPGD P15428 5/20 0.67
HSD17B10 Q99714 5/20 0.67
CYP1A2 P05177 1/20 0.67
TOP2A P11388 1/20 0.67
CYP2C9 P11712 1/20 0.67
TOP2B Q02880 1/20 0.67
MAPT P10636 1/20 0.48
KCNH2 Q12809 2/20 0.45
HRH3 Q9Y5N1 1/20 0.45
HTT P42858 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PIK3CG P48736 4/20 0.44
PIK3CD O00329 3/20 0.44
PIK3R1 P27986 3/20 0.44
PIK3CA P42336 3/20 0.44
POLB P06746 1/20 0.43
PRKD3 O94806 1/20 0.43

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
SCHEMBL5184138 0.87 KDM4E (0.54) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL15502434 0.86 KDM4E (0.53) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL10804487 0.86 KDM4E (0.50) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL3699287 0.83 KDM4E (0.55) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL27670321 0.82 LMNA (0.53) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL10813115 0.81 KDM4E (0.53) KDM4EALDH1A1LMNAHPGDHSD17B10
Ciprofloxacin SCHEMBL2900 0.80 KDM4E (1.00) KDM4EALDH1A1LMNAHPGDHSD17B10
Ciprofloxacin SCHEMBL4459712 0.80 KDM4E (1.00) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL10809588 0.80 KDM4E (0.77) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL5549811 0.80 KDM4E (0.74) KDM4EALDH1A1LMNAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0191390-B1 1-Cyclopropyl-1,4-dihydro-4-oxo-7-[4-(oxo-1,3-dioxol-4-yl-methyl)-1-piperazinyl]-quinoline-3-carboxylic acids, process for their preparation and bactericides containing them BAYER AG (DE) 1989-08-23 EP claimed
CN-114437154-B Ketone lactone derivative containing quinolone and preparation method and application thereof 北京理工大学 2024-03-01 CN disclosed
CN-117338732-A Ciprofloxacin hydrochloride freeze-dried powder injection for injection and preparation method thereof 海南久常制药有限公司 2024-01-05 CN disclosed
EP-1401829-B1 NOVEL HETEROCYCLIC ANTIBACTERIAL COMPOUNDS MICROBIOTIX INC (US) 2012-08-22 EP disclosed
EP-1453846-B1 14 OR 15 MEMBERED MACROLIDES WITH ANTIBACTERIAL ACTIVITY GLAXO GROUP LTD (GB) 2007-05-16 EP disclosed
US-7202221-B2 Macrolides GLAXO GROUP LIMITED (GB) 2007-04-10 US disclosed
CN-1307194-C Macrolides GLAXO GROUP LTD (GB) 2007-03-28 CN disclosed
CN-1612888-A Macrolides GLAXO GROUP LTD (GB) 2005-05-04 CN disclosed
US-20050080025-A1 Macrolides PLIVA D.D. (HR) 2005-04-14 US disclosed
EP-1453846-A1 MACROLIDES GLAXO GROUP LIMITED (GB) 2004-09-08 EP disclosed
EP-0118854-B1 BACTERICIDAL AGENT CONTAINING QUINOLONE-CARBOXYLIC ACIDS BAYER AG (DE) 1986-07-23 EP disclosed
US-4563448-A PHYTOPATHOGENS BAYER AKTIENGESELLSCHAFT (DE) 1986-01-07 US disclosed
US-4563459-A FUNGICIDES AND BACTERICIDES FOR AGRICULTURAL USE 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-0117474-A1 Quinolone carboxylic acids, process for their preparation and antibacterial compositions containing them BAYER AG (DE) 1984-09-05 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-0113091-A1 Microbiocidal agents based on quinolone-carboxylic acids BAYER AG (DE) 1984-07-11 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050080025-A1 Macrolides IL17A, CYP51A1, IL15 KDM4E 2733/4885ALDH1A1 2889/4885LMNA 1397/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.