SCHEMBL9560805

SCHEMBL9560805

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

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 7/20 0.51
TOP1 P11387 4/20 0.51
KDM4E B2RXH2 9/20 0.50
HPGD P15428 6/20 0.49
HSD17B10 Q99714 6/20 0.49
ALDH1A1 P00352 5/20 0.49
ALB P02768 1/20 0.49
HRH3 Q9Y5N1 1/20 0.49
AADAT Q8N5Z0 2/20 0.48
TUBB4A P04350 1/20 0.48
POLB P06746 1/20 0.48
TUBB P07437 1/20 0.48
TUBA3C P0DPH7 1/20 0.48
TUBA1B P68363 1/20 0.48
TUBA4A P68366 1/20 0.48
TUBB4B P68371 1/20 0.48
TUBB3 Q13509 1/20 0.48
TUBB2A Q13885 1/20 0.48
TUBB8 Q3ZCM7 1/20 0.48
TUBA3E Q6PEY2 1/20 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
SCHEMBL9461276 0.89 KDM4E (0.62) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9560809 0.89 KDM4E (0.41) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9560633 0.88 TOP2A (0.49) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9513013 0.87 TOP2A (0.62) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9513066 0.86 TOP2A (0.59) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9569177 0.84 TOP2A (0.53) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9510209 0.81 KDM4E (0.62) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9388538 0.79 TOP1 (0.54) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL9560636 0.78 ALDH1A1 (0.41) TOP2ATOP1KDM4EHPGDHSD17B10
SCHEMBL10914433 0.78 HPGD (0.55) TOP2ATOP1KDM4EHPGDHSD17B10

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