SCHEMBL20280667

SCHEMBL20280667

COc1cc2nc(NCCNC(=O)c3nnc(-c4ccccc4)o3)nc(NCCc3ccccc3)c2cc1OC

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.51
PDE4A P27815 2/20 0.49
PDE4B Q07343 2/20 0.49
PDE4C Q08493 2/20 0.49
PDE4D Q08499 2/20 0.49
EHMT2 Q96KQ7 2/20 0.47
HDAC3 O15379 1/20 0.47
HDAC4 P56524 1/20 0.47
HDAC1 Q13547 1/20 0.47
HDAC7 Q8WUI4 1/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC10 Q969S8 1/20 0.47
HDAC11 Q96DB2 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
HDAC9 Q9UKV0 1/20 0.47
HDAC5 Q9UQL6 1/20 0.47
MAPK1 P28482 1/20 0.47
ACHE P22303 4/20 0.47
APP P05067 3/20 0.47

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
SCHEMBL20280937 0.85 HIF1A (0.46) HIF1A
SCHEMBL20280942 0.78 CYP1A2 (0.46) HIF1A
SCHEMBL20281113 0.77 TP53 (0.50)
SCHEMBL20280836 0.76 PDE4A (0.64) PDE4APDE4BPDE4CPDE4DEHMT2
SCHEMBL23343246 0.75 HIF1A (0.47) HIF1AMAPK1
SCHEMBL20280954 0.73 TLR8 (0.40)
SCHEMBL20266987 0.70 APP (0.71) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL20280939 0.69 HDAC3 (0.42) EHMT2HDAC3HDAC4HDAC1HDAC7
SCHEMBL12175849 0.69 EGFR (0.68) EHMT2ACHEAPPBCHEKDM1A
SCHEMBL20281112 0.69 CDK2 (0.42)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11718609-B2 Heparanase inhibitors and use thereof Beta Therapeutics Pty Ltd (AU) 2023-08-08 US disclosed
US-20210130338-A1 Heparanase Inhibitors and Use Thereof Beta Therapeutics Pty Ltd (AU) 2021-05-06 US disclosed
US-20200093852-A1 Methods of Treating Ocular Disorders Beta Therapeutics Pty Ltd (AU) 2020-03-26 US disclosed
WO-2018107200-A1 HEPARANASE INHIBITORS AND USE THEREOF Beta Therapeutics Pty Ltd (AU) 2018-06-21 WO disclosed
WO-2018107226-A1 METHODS OF TREATING OCULAR DISORDERS Beta Therapeutics Pty. Ltd. (AU) 2018-06-21 WO 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-20200093852-A1 Methods of Treating Ocular Disorders ALDH1A2, HPSE, RB1 HIF1A 366/4885PDE4A 1590/4885PDE4B 1743/4885
US-20210130338-A1 Heparanase Inhibitors and Use Thereof HPSE, HEXD, ENGASE HIF1A 680/4885PDE4A 2726/4885PDE4B 2803/4885
US-11718609-B2 Heparanase inhibitors and use thereof HPSE, HEXD, ENGASE HIF1A 680/4885PDE4A 2726/4885PDE4B 2803/4885

“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.