SCHEMBL8941916

SCHEMBL8941916

CCOC(=O)c1cn(OC)c2nc3cc(N4CC(NC)C4)c(F)cc3cc2c1=O

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.41
HPGD P15428 3/20 0.41
ALDH1A1 P00352 3/20 0.41
HSD17B10 Q99714 2/20 0.41
ADRB2 P07550 1/20 0.37
USP28 Q96RU2 1/20 0.36
USP25 Q9UHP3 1/20 0.36
KMT2A Q03164 3/20 0.35
CYP2C19 P33261 1/20 0.35
TOP1 P11387 1/20 0.34
TOP2B Q02880 1/20 0.34
HTT P42858 1/20 0.34
OPRK1 P41145 1/20 0.34
TSHR P16473 2/20 0.33
STAT3 P40763 1/20 0.33
MAPT P10636 1/20 0.33
THRB P10828 1/20 0.33
MEN1 O00255 1/20 0.33
MAPK1 P28482 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
SCHEMBL8942065 0.89 TOP1 (0.41) KDM4EHPGDALDH1A1HSD17B10KMT2A
SCHEMBL9775869 0.85 KDM4E (0.47) KDM4EHPGDALDH1A1HSD17B10KMT2A
SCHEMBL8942074 0.84 KMT2A (0.46) KDM4EHPGDALDH1A1HSD17B10ADRB2
SCHEMBL8941993 0.82 KDM4E (0.42) KDM4EHPGDALDH1A1HSD17B10ADRB2
SCHEMBL8941971 0.82 KDM4E (0.41) KDM4EHPGDALDH1A1HSD17B10ADRB2
SCHEMBL8941959 0.81 ADRB2 (0.43) KDM4EHPGDALDH1A1HSD17B10ADRB2
SCHEMBL8942039 0.81 ALDH1A1 (0.51) KDM4EHPGDALDH1A1HSD17B10KMT2A
SCHEMBL8942147 0.79 ALDH1A1 (0.40) KDM4EHPGDALDH1A1HSD17B10ADRB2
SCHEMBL8942168 0.78 LMNA (0.52) KDM4EHPGDALDH1A1HSD17B10KMT2A
SCHEMBL8942157 0.78 KDM4E (0.44) KDM4EHPGDALDH1A1HSD17B10ADRB2

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