SCHEMBL9749111

SCHEMBL9749111

CN1C2CCC1CN(c1cc3c(cc1F)c(=O)c(C(=O)O)cn3-c1ccc(F)cc1)C2

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.72
KMT2A Q03164 2/20 0.72
MEN1 O00255 1/20 0.72
ALDH1A1 P00352 5/20 0.66
KDM4E B2RXH2 5/20 0.66
HPGD P15428 3/20 0.66
HSD17B10 Q99714 3/20 0.66
CYP1A2 P05177 1/20 0.51
TOP2A P11388 1/20 0.51
CYP2C9 P11712 1/20 0.51
TOP2B Q02880 1/20 0.51
MAPT P10636 1/20 0.51
TOP1 P11387 1/20 0.47
DRD3 P35462 1/20 0.47
PIK3CD O00329 3/20 0.45
PIK3R1 P27986 3/20 0.45
PIK3CA P42336 3/20 0.45
PIK3CG P48736 3/20 0.45

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
SCHEMBL9748511 0.85 ALDH1A1 (0.58) LMNAKMT2AMEN1ALDH1A1KDM4E
Difloxacin SCHEMBL148765 0.84 LMNA (1.00) LMNAKMT2AMEN1ALDH1A1KDM4E
Difloxacin SCHEMBL29695838 0.84 LMNA (1.00) LMNAKMT2AMEN1ALDH1A1KDM4E
SCHEMBL9184515 0.84 KDM4E (0.71) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL9748540 0.84 KDM4E (0.71) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10663315 0.84 LMNA (0.68) LMNAKMT2AMEN1ALDH1A1KDM4E
Difloxacin SCHEMBL203110 0.83 LMNA (0.98) LMNAKMT2AMEN1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL10561159 0.83 KDM4E (0.70) LMNAALDH1A1KDM4EHPGDHSD17B10
SCHEMBL10530683 0.83 LMNA (0.69) LMNAKMT2AMEN1ALDH1A1KDM4E
Difloxacin SCHEMBL27973383 0.82 LMNA (0.96) LMNAKMT2AMEN1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5091383-A SUBSTITUTED BRIDGED DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS PFIZER INC. (US) 1992-02-25 US disclosed
EP-0215650-B1 SUBSTITUTED BRIDGED-DIAZABICYCLOALKYL QUINOLONE CARBOXYLIC ACIDS PFIZER INC. (US) 1992-01-29 EP disclosed
US-5045549-A Bactericides CHEMIE LINZ GESELLSCHAFT M.B.H. (AT) 1991-09-03 US disclosed
US-4861779-A Anti-bacterial substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1989-08-29 US disclosed
US-4775668-A Substituted bridged-diazabicycloalkyl quinolone carboxylic acids and anti-bacterial use thereof PFIZER INC. (US) 1988-10-04 US disclosed
EP-0215650-A2 Substituted bridged-diazabicycloalkyl quinolone carboxylic acids PFIZER INC. (US) 1987-03-25 EP disclosed