SCHEMBL8325561

SCHEMBL8325561

C=Cc1c(F)c(N2CC3C=CC=CC3(N)C2)cc2c1c(=O)c(OC(=O)O)cn2C1CC1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.34
HRH3 Q9Y5N1 1/20 0.34
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
LMNA P02545 2/20 0.31
HPGD P15428 2/20 0.31
HSD17B10 Q99714 2/20 0.31
MAPT P10636 1/20 0.31
CYP1A2 P05177 1/20 0.31
TOP2A P11388 1/20 0.31
CYP2C9 P11712 1/20 0.31
TOP2B Q02880 1/20 0.31

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
SCHEMBL8325558 0.88 KCNH2 (0.46) KCNH2HRH3KDM4EALDH1A1LMNA
SCHEMBL8923870 0.84 KCNH2 (0.42) KCNH2HRH3KDM4EALDH1A1LMNA
SCHEMBL8323758 0.83 KDM4E (0.45) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL8923882 0.82 KCNH2 (0.35) KCNH2HRH3ALDH1A1TOP2ATOP2B
SCHEMBL8323776 0.79 MEN1 (0.44) KCNH2KDM4EALDH1A1HPGDHSD17B10
SCHEMBL8322415 0.78 KCNH2 (0.47) KCNH2TOP2ATOP2B
SCHEMBL8322083 0.77 MEN1 (0.37) KCNH2TOP2ATOP2B
SCHEMBL8322527 0.77 KDM4E (0.33) KDM4EALDH1A1LMNAHPGDHSD17B10
SCHEMBL8324816 0.76 KCNH2 (0.42) KCNH2KDM4EALDH1A1LMNAHPGD
SCHEMBL8322831 0.76 ALDH1A1 (0.35) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0705828-B1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1999-12-01 EP disclosed
EP-0705828-A1 Quinolone- and naphthyridone carboxylic acid derivatives as antibacterial agents BAYER AG (DE) 1996-04-10 EP disclosed