SCHEMBL9300903

SCHEMBL9300903

CCOC(=O)CCc1c(NC(C)=O)cc(CO)cc1Nc1c2ccccc2nc2ccccc12

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 10/20 0.51
KDM4E B2RXH2 3/20 0.47
POLB P06746 3/20 0.47
GLA P06280 1/20 0.47
TOP2B Q02880 6/20 0.46
MAPT P10636 3/20 0.44
KMT2A Q03164 3/20 0.44
KDM1A O60341 1/20 0.44
MITF O75030 1/20 0.44
LMNA P02545 1/20 0.44
RAD52 P43351 1/20 0.44
RECQL P46063 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
CYP4F2 P78329 2/20 0.44
CYP4A11 Q02928 2/20 0.44
MAPK1 P28482 1/20 0.41
MEN1 O00255 1/20 0.39
GAA P10253 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
SCHEMBL9300657 0.95 TOP2A (0.53) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9301425 0.94 TOP2A (0.53) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9300208 0.90 KDM4E (0.48) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9300532 0.89 TOP2A (0.62) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9300665 0.88 TOP2A (0.52) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9299718 0.84 TOP2A (0.64) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9300639 0.83 TOP2A (0.60) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9300838 0.83 TOP2A (0.54) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9301382 0.82 TOP2A (0.53) TOP2AKDM4EPOLBGLATOP2B
SCHEMBL9300901 0.81 KDM4E (0.48) TOP2AKDM4EPOLBGLATOP2B

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-5354864-A Antitumor agents SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1994-10-11 US claimed