SCHEMBL6162258

SCHEMBL6162258

CCc1nc(OC)c(C(N)=O)cc1C(=O)NCCC(=O)Nc1cc(CO)cc(Nc2c3ccccc3nc3c(OC)cccc23)c1

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.47
TOP2B Q02880 5/20 0.47
PARP1 P09874 2/20 0.44
KMT2A Q03164 1/20 0.38
KDM1A O60341 3/20 0.38
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
PDE4B Q07343 1/20 0.35

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
SCHEMBL6162333 0.93 TOP2A (0.55) TOP2ATOP2BPARP1KMT2AMAPT
SCHEMBL6159102 0.91 TOP2A (0.46) TOP2ATOP2BPARP1KMT2AKDM1A
SCHEMBL5405656 0.87 PARP1 (0.44) TOP2ATOP2BPARP1KDM1APDE4B
SCHEMBL5405660 0.79 TOP2A (0.41) TOP2ATOP2BPARP1KDM1ATP53
SCHEMBL5398721 0.79 TOP2A (0.47) TOP2ATOP2BPARP1KMT2AKDM1A
SCHEMBL5401753 0.78 TOP2A (0.40) TOP2ATOP2BPARP1KMT2AKDM1A
SCHEMBL6175432 0.76 TOP2A (0.39) TOP2ATOP2BKMT2AMAPTTP53
SCHEMBL5401693 0.76 TOP2A (0.43) TOP2ATOP2BPARP1
SCHEMBL3981078 0.74 TOP2A (0.52) TOP2ATOP2BPARP1KDM1A
SCHEMBL5428900 0.74 TOP2A (0.52) TOP2ATOP2BPARP1KDM1A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1487799-A4 9-AMINOACRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARM CO LTD (KR) 2005-06-01 EP disclosed
EP-1487799-A1 9-AMINOACRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2004-12-22 EP disclosed
WO-2003074490-A1 9-AMINOACRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2003-09-12 WO disclosed