SCHEMBL21609233

SCHEMBL21609233

COc1cccc2onc(NS(=O)(=O)c3cc(C)cc4cccnc34)c12

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
KAT6A Q92794 13/20 0.50
KAT7 O95251 11/20 0.50
KAT6B Q8WYB5 8/20 0.50
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
KAT5 Q92993 6/20 0.49
KAT8 Q9H7Z6 6/20 0.49
SLC40A1 Q9NP59 1/20 0.47
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46

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
SCHEMBL29652533 1.00 TSHR (0.51) TSHRKAT6AKAT7KAT6BALDH1A1
SCHEMBL29652425 0.89 ALDH1A1 (0.62) TSHRKAT6AKAT7KAT6BALDH1A1
SCHEMBL21609134 0.89 ALDH1A1 (0.62) TSHRKAT6AKAT7KAT6BALDH1A1
SCHEMBL21641914 0.87 KAT6A (0.47) TSHRKAT6AKAT7KAT6BALDH1A1
SCHEMBL29652464 0.87 KAT6A (0.47) TSHRKAT6AKAT7KAT6BALDH1A1
SCHEMBL21609242 0.82 KAT6A (0.65) KAT6AKAT7KAT6BALDH1A1POLB
SCHEMBL29652383 0.82 KAT6A (0.65) KAT6AKAT7KAT6BALDH1A1POLB
SCHEMBL21660506 0.81 KAT6A (0.57) KAT6AKAT7KAT6BKAT5KAT8
SCHEMBL21609004 0.81 KAT6A (0.52) TSHRKAT6AKAT7KAT6BALDH1A1
SCHEMBL29652364 0.81 KAT6A (0.57) KAT6AKAT7KAT6BKAT5KAT8

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
EP-3810602-B1 COMPOUNDS CTXT PTY LTD (AU) 2023-11-01 EP disclosed
US-20220153710-A1 Compounds CTXT PTY LTD (AU) 2022-05-19 US disclosed
US-20200039945-A1 Compounds CTXT PTY LIMITED (AU) 2020-02-06 US disclosed
US-20200039945-A1 Compounds CTXT PTY LIMITED (AU) 2020-02-06 US disclosed
WO-2019243491-A1 COMPOUNDS CTXT PTY LIMITED (AU) 2019-12-26 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 (2 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-20220153710-A1 Compounds SLC10A1, ABCB11, PCSK9 TSHR 3584/4885KAT6A 877/4885KAT7 490/4885
US-20200039945-A1 Compounds SLC10A1, ABCB11, PCSK9 TSHR 3583/4885KAT6A 878/4885KAT7 490/4885

“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.