SCHEMBL9560636

SCHEMBL9560636

CCOC(=O)N1CCN(c2c(F)cc3c(=O)c(OC(=O)O)cn4c3c2OC=C4C)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
KDM4E B2RXH2 6/20 0.40
TOP1 P11387 2/20 0.39
TOP2A P11388 1/20 0.39
HPGD P15428 3/20 0.39
ALOX15 P16050 2/20 0.39
LMNA P02545 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
USP2 O75604 1/20 0.39
TP53 P04637 1/20 0.39
ALOX12 P18054 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HSD17B10 Q99714 2/20 0.39
ALB P02768 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
AADAT Q8N5Z0 2/20 0.38
TUBB4A P04350 1/20 0.38
POLB P06746 1/20 0.38
TUBB P07437 1/20 0.38
TUBA3C P0DPH7 1/20 0.38

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
SCHEMBL9560633 0.90 TOP2A (0.49) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9560809 0.89 KDM4E (0.41) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9512776 0.88 KDM4E (0.51) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9513019 0.85 TOP2A (0.49) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9569172 0.85 TOP2A (0.43) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9513068 0.85 KDM4E (0.48) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9569180 0.83 TOP2A (0.42) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9560176 0.80 KDM4E (0.49) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9510219 0.80 KDM4E (0.51) ALDH1A1KDM4ETOP1TOP2AHPGD
SCHEMBL9560462 0.79 KDM4E (0.37) ALDH1A1KDM4ETOP1TOP2AHPGD

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