SCHEMBL9537382

SCHEMBL9537382

O=C(O)c1cn(-c2ccc(F)cc2)c2nc(N3CCCC3)c(F)cc2c1=O

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.59
EPHA2 P29317 1/20 0.59
FLT4 P35916 1/20 0.59
GSK3B P49841 1/20 0.59
RARB P10826 1/20 0.59
TBXAS1 P24557 1/20 0.59
SLC6A3 Q01959 1/20 0.59
LMNA P02545 5/20 0.54
KDM4E B2RXH2 4/20 0.54
ALDH1A1 P00352 3/20 0.54
HPGD P15428 3/20 0.54
HSD17B10 Q99714 3/20 0.54
POLB P06746 2/20 0.54
XBP1 P17861 1/20 0.54
NFKB1 P19838 1/20 0.54
HTT P42858 1/20 0.54
NFKB2 Q00653 1/20 0.54
RELA Q04206 1/20 0.54
CYP2C9 P11712 1/20 0.53
ATP6V1B2 P21281 1/20 0.53

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
SCHEMBL9537740 0.99 KMT2A (0.58) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL9539879 0.94 KMT2A (0.55) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL9539015 0.93 KMT2A (0.54) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL9539001 0.93 KMT2A (0.55) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL9536803 0.92 KMT2A (0.55) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL11017256 0.91 LMNA (0.62) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL11021112 0.91 KMT2A (0.57) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL4902751 0.91 LMNA (0.66) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL10904821 0.91 LMNA (0.66) KMT2AEPHA2FLT4GSK3BRARB
SCHEMBL11016026 0.91 KMT2A (0.57) KMT2AEPHA2FLT4GSK3BRARB

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-0153580-B2 NAPHTHYRIDINE ANTIBACTERIAL COMPOUNDS ABBOTT LABORATORIES (US) 1993-03-17 EP disclosed
EP-0153580-A1 Naphthyridine antibacterial compounds ABBOTT LABORATORIES (US) 1985-09-04 EP disclosed