SCHEMBL16171228

SCHEMBL16171228

COc1c(NC(C)=O)ccc2c(Nc3ccccc3)ccnc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TOP2A P11388 6/20 0.43
▸ ATM Q13315 1/20 0.43
▸ GAK O14976 1/20 0.42
▸ RIPK2 O43353 1/20 0.42
▸ COQ8A Q8NI60 1/20 0.42
▸ NLK Q9UBE8 1/20 0.42
▸ POLB P06746 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ JAK2 O60674 1/20 0.40
▸ JAK3 P52333 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ IDO1 P14902 1/20 0.40
▸ ALK Q9UM73 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ PDGFRA P16234 1/20 0.39
▸ DNMT1 P26358 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
SCHEMBL22500914 0.89 TOP2A (0.47) TOP2AATMGAKRIPK2COQ8A
SCHEMBL22500935 0.88 TOP2A (0.46) TOP2AATMGAKPOLBIDO1
SCHEMBL16171227 0.88 CDC25B (0.53) DNMT1DNMT3A
SCHEMBL22500967 0.88 ERBB2 (0.48) TOP2AATMGAKMAPTCYP1A2
SCHEMBL22500884 0.87 TOP2A (0.52) TOP2AATMGAKPOLBMAPT
SCHEMBL22500986 0.85 TOP2A (0.53) TOP2AGAKRIPK2COQ8ANLK
SCHEMBL16171225 0.85 TOP2A (0.58) TOP2APOLBMAPTJAK2JAK3
SCHEMBL22500861 0.82 TOP2A (0.58) TOP2AATMKDM4ECYP1A2CYP2C9
SCHEMBL22500911 0.80 TOP2A (0.53) TOP2AATMKDM4ECYP1A2CYP2C9
SCHEMBL16171230 0.79 PIK3CA (0.47) TOP2AATMJAK2JAK3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12291502-B2 Topoisomerase II-alpha inhibitors and methods of treating cancer using the same THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2025-05-06 — — US disclosed
US-20230105776-A1 Topoisomerase II-alpha Inhibitors and Methods of Treating Cancer Using the Same UNITED STATES GOVERNMENT 2023-04-06 — — US disclosed
WO-2020205991-A1 TOPOISOMERASE II-alpha INHIBITORS AND METHODS OF TREATING CANCER USING THE SAME THE REGENTS OF THE UNIVERSITY OF COLORADO, A BODY CORPORATE (US) 2020-10-08 — — WO disclosed
US-20140309257-A1 TOPOISOMERASE INHIBITORS AND METHODS OF MAKING AND USE AS THERAPEUTIC AGENTS UNITED STATES GOVERNMENT 2014-10-16 — — 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 (3 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-20230105776-A1 Topoisomerase II-alpha Inhibitors and Methods of Treating Cancer Using the Same TOP2A, TOP1, TOP2B TOP2A 1/4885ATM 733/4885GAK 601/4885
US-12291502-B2 Topoisomerase II-alpha inhibitors and methods of treating cancer using the same TOP2A, TOP1, TOP2B TOP2A 1/4885ATM 733/4885GAK 601/4885
US-20140309257-A1 TOPOISOMERASE INHIBITORS AND METHODS OF MAKING AND USE AS THERAPEUTIC AGENTS TOP2A, TOP1, TOP2B TOP2A 1/4885ATM 2075/4885GAK 1031/4885

“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.

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