SCHEMBL8925665

SCHEMBL8925665

C[C@H](N)[C@H]1CCN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)C1

nearest known ligand 0.67

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.67
DPP4 P27487 6/20 0.61
CHRM2 P08172 1/20 0.58
DRD1 P21728 1/20 0.58
KMT2A Q03164 1/20 0.55
LMNA P02545 2/20 0.54
KDM4E B2RXH2 1/20 0.54
ABCC4 O15439 1/20 0.54
HSD17B10 Q99714 1/20 0.54
DHFR P00374 1/20 0.49
CYP2C9 P11712 1/20 0.49
ATP6V1B2 P21281 1/20 0.49
TBXA2R P21731 1/20 0.49
EDNRA P25101 1/20 0.49
TARBP2 Q15633 1/20 0.49
EPHA2 P29317 1/20 0.48
FLT4 P35916 1/20 0.48
GSK3B P49841 1/20 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
SCHEMBL8924291 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL8924280 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL8925459 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL8925761 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL9428216 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL8926259 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL9457142 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL8925529 1.00 KCNH2 (0.67) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL8923810 0.90 DPP4 (0.58) KCNH2DPP4CHRM2DRD1KMT2A
SCHEMBL8925490 0.90 DPP4 (0.58) KCNH2DPP4CHRM2DRD1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5633264-A Individual stereoisomers of 7-[3-(1-aminoalkyl)-1-pyrrolidinyl]-Quinolones and naphthyridones as antibacterial agents WARNER-LAMBERT COMPANY (US) 1997-05-27 US disclosed
US-5563155-A QUINOLONE ANTIBIOTICS WITH INCREASED EFFICACY, REDUCED SIDE EFFECTS WARNER-LAMBERT COMPANY (US) 1996-10-08 US disclosed
US-5461165-A Individual stereoisomers of intermediates of 7-[3-(1-aminoalkyl)-1-pyrrolidinyl]-quinolones and naphthyridones as antibacterial agents WARNER-LAMBERT COMPANY (US) 1995-10-24 US disclosed
US-5344940-A Bactericides WARNER-LAMBERT COMPANY (US) 1994-09-06 US disclosed