SCHEMBL9537192

SCHEMBL9537192

CC1CN(c2nc3c(cc2F)c(=O)c(C(=O)O)cn3-c2ccc(F)cc2)CC(C)N1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 1/20 0.61
FLT4 P35916 1/20 0.61
GSK3B P49841 1/20 0.61
RARB P10826 1/20 0.61
TBXAS1 P24557 1/20 0.61
SLC6A3 Q01959 1/20 0.61
LMNA P02545 4/20 0.58
KDM4E B2RXH2 3/20 0.58
ALDH1A1 P00352 3/20 0.58
HPGD P15428 3/20 0.58
HSD17B10 Q99714 3/20 0.58
POLB P06746 1/20 0.58
XBP1 P17861 1/20 0.58
NFKB1 P19838 1/20 0.58
HTT P42858 1/20 0.58
NFKB2 Q00653 1/20 0.58
RELA Q04206 1/20 0.58
KMT2A Q03164 2/20 0.56
DPP4 P27487 6/20 0.53
CYP2C9 P11712 2/20 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
SCHEMBL11036827 0.94 EPHA2 (0.56) EPHA2FLT4GSK3BRARBTBXAS1
SCHEMBL9536405 0.93 EPHA2 (0.57) EPHA2FLT4GSK3BRARBTBXAS1
SCHEMBL8134115 0.87 EPHA2 (0.57) EPHA2FLT4GSK3BRARBTBXAS1
Hydrochloric Acid SCHEMBL8123019 0.87 EPHA2 (0.56) EPHA2FLT4GSK3BRARBTBXAS1
SCHEMBL8131883 0.84 EPHA2 (0.58) EPHA2FLT4GSK3BRARBTBXAS1
SCHEMBL9537382 0.84 KMT2A (0.59) EPHA2FLT4GSK3BRARBTBXAS1
Hydrochloric Acid SCHEMBL8130765 0.84 EPHA2 (0.57) EPHA2FLT4GSK3BRARBTBXAS1
SCHEMBL10904821 0.83 LMNA (0.66) EPHA2FLT4GSK3BRARBTBXAS1
SCHEMBL4902751 0.83 LMNA (0.66) EPHA2FLT4GSK3BRARBTBXAS1
SCHEMBL8483303 0.83 EPHA2 (0.59) EPHA2FLT4GSK3BRARBTBXAS1

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