SCHEMBL17879718

SCHEMBL17879718

Cn1cc(B2OC(C)(C)C(C)(C)O2)c2ccn(C)c2c1=O

nearest known ligand 0.37

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
JAK2 O60674 3/20 0.37
BTK Q06187 3/20 0.37
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA9 Q16790 1/20 0.31

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
SCHEMBL20384529 0.85 JAK2 (0.34) JAK2BTK
SCHEMBL19663740 0.84 JAK2 (0.34) JAK2BTK
SCHEMBL23403836 0.84 JAK2 (0.34) JAK2BTK
SCHEMBL16649616 0.79 BRD4 (0.46) JAK2BTK
SCHEMBL29613202 0.79 BRD4 (0.46) JAK2BTK
SCHEMBL21652828 0.78 BUB1 (0.38) JAK2BTK
SCHEMBL15069430 0.78 BRD4 (0.48) JAK2BTKCA1CA2
SCHEMBL16738878 0.78 DGAT1 (0.32) JAK2BTK
SCHEMBL25130053 0.78 JAK2 (0.32) JAK2BTK
SCHEMBL23403832 0.77 RAPGEF4 (0.36) JAK2BTK

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
WO-2024054955-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 WO disclosed
WO-2024054956-A1 HETEROBIFUNCTIONAL COMPOUNDS AND METHODS OF TREATING DISEASE HALDA THERAPEUTICS OPCO, INC. (US) 2024-03-14 WO disclosed
US-9957263-B2 Bromodomain inhibitors ABBVIE INC. (US) 2018-05-01 US disclosed
US-20160272630-A1 Bromodomain Inhibitors ABBVIE INC. (US) 2016-09-22 US disclosed
US-20160185769-A1 Bromodomain Inhibitors ABBVIE INC. (US) 2016-06-30 US 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-20160272630-A1 Bromodomain Inhibitors BRD4, BRDT, EP300 JAK2 864/4885BTK 1072/4885CA1 3997/4885
US-20160185769-A1 Bromodomain Inhibitors BRD1, BRD4, BRD3 JAK2 383/4885BTK 988/4885CA1 1577/4885

“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.