SCHEMBL11089508

SCHEMBL11089508

CCOC(=O)N1CCN(c2nc3[nH]cc(C(=O)O)c(=O)c3cc2F)CC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.51
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
HSD17B10 Q99714 4/20 0.51
CYP2C9 P11712 2/20 0.51
POLB P06746 2/20 0.51
LMNA P02545 4/20 0.48
ATP6V1B2 P21281 1/20 0.48
TBXA2R P21731 1/20 0.48
EDNRA P25101 1/20 0.48
TARBP2 Q15633 1/20 0.48
ALDH1A1 P00352 6/20 0.43
MAPT P10636 8/20 0.43
MAPK1 P28482 2/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
HTT P42858 4/20 0.43
PIM3 Q86V86 2/20 0.42
RPS6KB1 P23443 1/20 0.42
MATK P42679 1/20 0.42

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
SCHEMBL11271171 0.92 MEN1 (0.52) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL11006549 0.85 KMT2A (0.51) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL11282959 0.85 MEN1 (0.50) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL11278689 0.84 LMNA (0.48) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL2097125 0.83 LMNA (0.48) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL2094951 0.83 LMNA (0.48) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL11500738 0.82 HTT (0.40) KDM4EMEN1KMT2AHSD17B10POLB
SCHEMBL9535386 0.81 LMNA (0.60) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL11270051 0.81 MEN1 (0.53) KDM4EMEN1KMT2AHSD17B10CYP2C9
SCHEMBL11334146 0.80 MEN1 (0.52) KDM4EMEN1KMT2AHSD17B10CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4442101-A TREATMENT OF BACTERIAL DISEASES DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1984-04-10 US disclosed
US-4359578-A Naphthyridine derivatives and salts thereof useful as antibacterial agents DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1982-11-16 US disclosed
US-4352803-A BACTERICIDES DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1982-10-05 US disclosed