SCHEMBL3985902

SCHEMBL3985902

COc1cccc2c(Nc3cc(N)cc(CO)c3)c3ccccc3nc12

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 9/20 0.71
TOP2B Q02880 8/20 0.71
KDM1A O60341 6/20 0.56
POLB P06746 3/20 0.50
RAD52 P43351 2/20 0.50
PARP1 P09874 2/20 0.49
GFER P55789 1/20 0.42
KMT2A Q03164 1/20 0.42

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
SCHEMBL8489010 0.87 TOP2A (0.78) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL8489781 0.85 TOP2A (0.67) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL8484693 0.84 TOP2A (0.73) TOP2ATOP2BKDM1A
SCHEMBL8489028 0.84 TOP2A (0.73) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL29536689 0.84 TOP2A (1.00) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL1865418 0.84 TOP2A (1.00) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL5428900 0.83 TOP2A (0.52) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL3981078 0.83 TOP2A (0.52) TOP2ATOP2BKDM1APOLBRAD52
SCHEMBL8484809 0.82 TOP2A (0.49) TOP2ATOP2BKDM1APARP1
SCHEMBL4937021 0.81 TOP2A (0.59) TOP2ATOP2BKDM1APOLBRAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1380574-B1 9-aminoacridine derivates and process for the preparation thereof SAMJIN PHARM CO LTD (KR) 2009-05-20 EP disclosed
EP-1380574-A1 9-aminoacridine derivates and process for the preparation thereof Samjin Pharmaceutical Co., Ltd. (KR) 2004-01-14 EP disclosed
US-6620936-B2 Antitumor agents, topoisomerase inhibitors, notoxic SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2003-09-16 US disclosed
US-20020111491-A1 9-aminoacridine derivatives and process for the preparation thereof SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2002-08-15 US disclosed
EP-1062207-A1 9-AMINOACRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF Samjin Pharmaceutical Co., Ltd. (KR) 2000-12-27 EP disclosed
WO-2000037447-A1 9-AMINOACRIDINE DERIVATIVES AND PROCESS FOR THE PREPARATION THEREOF SAMJIN PHARMACEUTICAL CO., LTD. (KR) 2000-06-29 WO disclosed
US-5939428-A ANTITUMOR AGENTS AND ANTIGROWTH AGENTS FOR CELLS NATIONAL HEALTH RESEARCH INSTITUTES (TW) 1999-08-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020111491-A1 9-aminoacridine derivatives and process for the preparation thereof ALKBH1, ADCY9, CCR9 TOP2A 1105/4885TOP2B 841/4885KDM1A 1325/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.