SCHEMBL20281112

SCHEMBL20281112

COc1cc2nc(NCCNC(=O)c3nnc(-c4c[nH]c5ncccc45)o3)nc(N)c2cc1OC

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 6/20 0.42
CCNT1 O60563 1/20 0.42
CCNA2 P20248 1/20 0.42
CDK9 P50750 1/20 0.42
CDC7 O00311 5/20 0.40
CCNE1 P24864 5/20 0.40
DBF4 Q9UBU7 5/20 0.40
MEN1 O00255 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
KMT2A Q03164 1/20 0.40

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 0.82 HIF1A (0.46) MEN1TP53MAPTKMT2A
SCHEMBL20280954 0.79 TLR8 (0.40) MEN1TP53MAPTKMT2A
SCHEMBL20281113 0.79 TP53 (0.50) MEN1TP53MAPTKMT2A
SCHEMBL20280948 0.73 TP53 (0.40) MEN1TP53MAPTKMT2A
SCHEMBL20281121 0.70 ADRA2A (0.40)
SCHEMBL6785331 0.70 TP53 (0.52) MEN1TP53MAPTKMT2A
SCHEMBL20280667 0.69 HIF1A (0.51)
SCHEMBL20281057 0.69 POLB (0.57) MEN1MAPTKMT2A
SCHEMBL20281124 0.69 ADRA2A (0.38)
SCHEMBL20280939 0.69 HDAC3 (0.42) MEN1TP53MAPTKMT2A

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 6 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-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 CDK2 131/4885CCNT1 3050/4885CCNA2 1785/4885
US-20210130338-A1 Heparanase Inhibitors and Use Thereof HPSE, HEXD, ENGASE CDK2 2096/4885CCNT1 4623/4885CCNA2 4787/4885
US-11718609-B2 Heparanase inhibitors and use thereof HPSE, HEXD, ENGASE CDK2 2096/4885CCNT1 4623/4885CCNA2 4787/4885

“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.