SCHEMBL31227008

SCHEMBL31227008

Cc1csc2ccnc(N[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)c12

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ BTK Q06187 4/20 0.46
▸ PIM1 P11309 2/20 0.43
▸ PIM2 Q9P1W9 2/20 0.43
▸ USP30 Q70CQ3 4/20 0.43
▸ ANO1 Q5XXA6 1/20 0.42
▸ JAK3 P52333 3/20 0.41
▸ PIK3CD O00329 1/20 0.41
▸ HDAC4 P56524 1/20 0.41
▸ HDAC6 Q9UBN7 1/20 0.41
▸ PARP1 P09874 1/20 0.40
▸ TRPV1 Q8NER1 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
SCHEMBL31227086 0.91 BTK (0.46) BTKPIM1PIM2USP30ANO1
SCHEMBL31227631 0.90 BTK (0.47) BTKPIM1PIM2USP30ANO1
SCHEMBL31227036 0.88 BTK (0.45) BTKPIM1PIM2USP30ANO1
SCHEMBL31227770 0.85 PIM1 (0.43) BTKPIM1PIM2USP30ANO1
SCHEMBL31227760 0.85 BTK (0.46) BTKPIM1PIM2USP30ANO1
SCHEMBL31227283 0.84 BTK (0.47) BTKPIM1PIM2USP30ANO1
SCHEMBL31227249 0.82 PIM1 (0.49) BTKPIM1PIM2USP30JAK3
SCHEMBL31227054 0.82 PIM1 (0.49) BTKPIM1PIM2USP30JAK3
SCHEMBL31227548 0.82 PIM1 (0.49) BTKPIM1PIM2USP30JAK3
SCHEMBL21599048 0.82 ANO1 (0.47) BTKPIM1PIM2USP30ANO1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240400555-A1 Compounds, Compositions and Methods for Attenuation of Mammalian Translation of C-MYC or N-MYC Proteins of the MYC Proto-Oncogene Family of BHLH Transcription Factors INITIAL THERAPEUTICS, INC. (US) 2024-12-05 — — US disclosed
WO-2024226875-A2 COMPOUNDS, COMPOSITIONS AND METHODS FOR ATTENUATION OF MAMMALIAN TRANSLATION OF C-MYC OR N-MYC PROTEINS OF THE MYC PROTO-ONCOGENE FAMILY OF BHLH TRANSCRIPTION FACTORS INITIAL THERAPEUTICS, INC. (US) 2024-10-31 — — 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 (1 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-20240400555-A1 Compounds, Compositions and Methods for Attenuation of Mammalian Translation of C-MYC or N-MYC Proteins of the MYC Proto-Oncogene Family of BHLH Transcription Factors MYCBP, MYC, MYCBP2 BTK 4542/4885PIM1 709/4885PIM2 1182/4885

“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.

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