SCHEMBL8941943

SCHEMBL8941943

CCOC(=O)c1cn(C)c2nc3cc(N4CC(N5CCCC5)C4)c(F)cc3cc2c1=O

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.43
ALDH1A1 P00352 3/20 0.43
HPGD P15428 3/20 0.43
HSD17B10 Q99714 2/20 0.43
KMT2A Q03164 3/20 0.36
MEN1 O00255 2/20 0.36
HTT P42858 1/20 0.36
CSF1R P07333 1/20 0.35
TSHR P16473 1/20 0.35
CASP1 P29466 1/20 0.35
TOP2B Q02880 1/20 0.34
ADRB2 P07550 1/20 0.34
GAA P10253 1/20 0.34
CYP2C19 P33261 1/20 0.34
STAT3 P40763 1/20 0.33

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
SCHEMBL8942058 0.88 ALDH1A1 (0.40) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL8942157 0.86 KDM4E (0.44) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL8941993 0.86 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL8941980 0.86 KDM4E (0.42) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL9786124 0.85 ALDH1A1 (0.48) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL8941971 0.85 KDM4E (0.41) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL7228015 0.82 ALDH1A1 (0.47) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL7234823 0.82 KMT2A (0.47) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL8942177 0.80 LMNA (0.47) KDM4EALDH1A1HPGDHSD17B10KMT2A
SCHEMBL8942135 0.80 ALDH1A1 (0.38) KDM4EALDH1A1HPGDHSD17B10KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5556861-A 1,8 benzonaphthyridine derivatives and antimicrobial compositions LABORATOIRE ROGER BELLON (FR) 1996-09-17 US disclosed