SCHEMBL20280836

SCHEMBL20280836

COc1cc2nc(NCCN)nc(NCCc3ccccc3)c2cc1OC

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.64
PDE4B Q07343 2/20 0.64
PDE4C Q08493 2/20 0.64
PDE4D Q08499 2/20 0.64
MAPK1 P28482 1/20 0.61
ACHE P22303 10/20 0.60
APP P05067 9/20 0.60
BCHE P06276 8/20 0.60
KDM1A O60341 4/20 0.58
EHMT2 Q96KQ7 4/20 0.58
RCOR1 Q9UKL0 4/20 0.58
TRIM58 Q8NG06 1/20 0.51
BCDIN3D Q7Z5W3 1/20 0.50

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
SCHEMBL20267158 0.82 HTR1A (0.60) MAPK1KDM1AEHMT2RCOR1
SCHEMBL30526272 0.82 HTR1A (0.60) MAPK1KDM1AEHMT2RCOR1
SCHEMBL20266987 0.81 APP (0.71) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL12175849 0.81 EGFR (0.68) ACHEAPPBCHEKDM1AEHMT2
SCHEMBL23260506 0.80 EHMT2 (0.63) KDM1AEHMT2RCOR1TRIM58
SCHEMBL9199076 0.78 PDE4A (1.00) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL25354735 0.78 PDE4A (0.64) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL21486528 0.78 EHMT2 (0.81) KDM1AEHMT2RCOR1
SCHEMBL8177852 0.76 MAPK1 (1.00) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL20280667 0.76 HIF1A (0.51) PDE4APDE4BPDE4CPDE4DMAPK1

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
US-11718609-B2 Heparanase inhibitors and use thereof Beta Therapeutics Pty Ltd (AU) 2023-08-08 US disclosed
US-11718609-B2 Heparanase inhibitors and use thereof Beta Therapeutics Pty Ltd (AU) 2023-08-08 US disclosed
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-2018107226-A1 METHODS OF TREATING OCULAR DISORDERS Beta Therapeutics Pty. Ltd. (AU) 2018-06-21 WO disclosed
WO-2018107200-A1 HEPARANASE INHIBITORS AND USE THEREOF 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 PDE4A 1590/4885PDE4B 1743/4885PDE4C 2013/4885
US-20210130338-A1 Heparanase Inhibitors and Use Thereof HPSE, HEXD, ENGASE PDE4A 2726/4885PDE4B 2803/4885PDE4C 2724/4885
US-11718609-B2 Heparanase inhibitors and use thereof HPSE, HEXD, ENGASE PDE4A 2726/4885PDE4B 2803/4885PDE4C 2724/4885

“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.