SCHEMBL20281113

SCHEMBL20281113

COc1cc2nc(NCCNC(=O)c3nnc(-c4cccc(F)c4)o3)nc(N)c2cc1OC

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.50
MAPT P10636 2/20 0.50
POLB P06746 2/20 0.50
RAD52 P43351 2/20 0.49
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
KDM4E B2RXH2 1/20 0.41

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 0.91 HIF1A (0.46) TP53MAPTMEN1KMT2A
SCHEMBL20280954 0.81 TLR8 (0.40) TP53MAPTMEN1KMT2A
SCHEMBL20281112 0.79 CDK2 (0.42) TP53MAPTMEN1KMT2A
SCHEMBL20280948 0.77 TP53 (0.40) TP53MAPTPOLBRAD52MEN1
SCHEMBL20280667 0.77 HIF1A (0.51)
SCHEMBL20281057 0.75 POLB (0.57) MAPTPOLBMEN1KMT2A
SCHEMBL23343246 0.75 HIF1A (0.47) TP53MAPTPOLBMEN1KMT2A
SCHEMBL20281124 0.75 ADRA2A (0.38)
SCHEMBL20280939 0.75 HDAC3 (0.42) TP53MAPTMEN1KMT2A
SCHEMBL20281121 0.73 ADRA2A (0.40)

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 TP53 2518/4885MAPT 1927/4885POLB 3101/4885
US-20210130338-A1 Heparanase Inhibitors and Use Thereof HPSE, HEXD, ENGASE TP53 3948/4885MAPT 3043/4885POLB 4015/4885
US-11718609-B2 Heparanase inhibitors and use thereof HPSE, HEXD, ENGASE TP53 3948/4885MAPT 3043/4885POLB 4015/4885

“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.