SCHEMBL20280939

SCHEMBL20280939

COc1cc2nc(NCCNC(=O)c3nnc(-c4ccccc4)s3)nc(N)c2cc1OC

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC7 Q8WUI4 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC10 Q969S8 1/20 0.42
HDAC11 Q96DB2 1/20 0.42
EHMT2 Q96KQ7 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
HDAC9 Q9UKV0 1/20 0.42
HDAC5 Q9UQL6 1/20 0.42
MEN1 O00255 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 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
SCHEMBL20281057 0.81 POLB (0.57) MEN1MAPTKMT2A
SCHEMBL20280937 0.81 HIF1A (0.46) MEN1TP53MAPTKMT2A
SCHEMBL6785331 0.75 TP53 (0.52) MEN1TP53MAPTKMT2A
SCHEMBL20281113 0.75 TP53 (0.50) MEN1TP53MAPTKMT2A
SCHEMBL4225543 0.72 NPY1R (0.50) TP53MAPT
SCHEMBL20280954 0.72 TLR8 (0.40) MEN1TP53MAPTKMT2A
SCHEMBL6781777 0.70 TP53 (0.50) MEN1TP53MAPTKMT2A
SCHEMBL20620281 0.70 ADRA1B (0.60) MEN1TP53MAPTKMT2A
SCHEMBL20280948 0.70 TP53 (0.40) MEN1TP53MAPTKMT2A
SCHEMBL20280667 0.69 HIF1A (0.51) HDAC3HDAC4HDAC1HDAC7HDAC2

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 HDAC3 15/4885HDAC4 46/4885HDAC1 50/4885
US-20210130338-A1 Heparanase Inhibitors and Use Thereof HPSE, HEXD, ENGASE HDAC3 379/4885HDAC4 666/4885HDAC1 344/4885
US-11718609-B2 Heparanase inhibitors and use thereof HPSE, HEXD, ENGASE HDAC3 379/4885HDAC4 666/4885HDAC1 344/4885

“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.