SCHEMBL9560809

SCHEMBL9560809

CCN1CCN(c2c(F)cc3c(=O)c(OC(=O)O)cn4c3c2OC=C4C)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 10/20 0.41
TOP2A P11388 6/20 0.40
TOP1 P11387 4/20 0.40
HPGD P15428 7/20 0.40
HSD17B10 Q99714 7/20 0.40
ALDH1A1 P00352 6/20 0.40
ALB P02768 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
AADAT Q8N5Z0 2/20 0.39
TUBB4A P04350 1/20 0.39
POLB P06746 1/20 0.39
TUBB P07437 1/20 0.39
TUBA3C P0DPH7 1/20 0.39
TUBA1B P68363 1/20 0.39
TUBA4A P68366 1/20 0.39
TUBB4B P68371 1/20 0.39
TUBB3 Q13509 1/20 0.39
TUBB2A Q13885 1/20 0.39
TUBB8 Q3ZCM7 1/20 0.39
TUBA3E Q6PEY2 1/20 0.39

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
SCHEMBL9512776 0.90 KDM4E (0.51) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9560636 0.89 ALDH1A1 (0.41) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9560805 0.89 TOP2A (0.51) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9513019 0.87 TOP2A (0.49) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9569172 0.86 TOP2A (0.43) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9513068 0.86 KDM4E (0.48) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9569180 0.84 TOP2A (0.42) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9560176 0.82 KDM4E (0.49) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9510219 0.81 KDM4E (0.51) KDM4ETOP2ATOP1HPGDHSD17B10
SCHEMBL9513057 0.80 TOP1 (0.41) KDM4ETOP2ATOP1HPGDHSD17B10

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
EP-0563732-A1 7-oxo-7H-pyrido(1,2,3-de)(1,4)benzoxazinecarboxylic acids and esters and their use as antiviral agents BAYER AG (DE) 1993-10-06 EP disclosed