SCHEMBL26414908

SCHEMBL26414908

CS(=O)(=O)c1ccc(OCC2CC2)c(B(O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 15/20 0.53
SLC6A9 P48067 4/20 0.52
KCNH2 Q12809 1/20 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
SCHEMBL20155682 0.81 BRD4 (0.59) BRD4SLC6A9
SCHEMBL20160101 0.80 BRD4 (0.55) BRD4SLC6A9
SCHEMBL16650725 0.80 BRD4 (0.55) BRD4SLC6A9
SCHEMBL2824930 0.80 SLC6A9 (0.59) BRD4SLC6A9KCNH2
SCHEMBL15068105 0.77 HTR2A (0.50) BRD4
SCHEMBL14059596 0.76 SMN1; SMN2 (0.61) KCNH2
SCHEMBL1813202 0.75 SLC6A9 (0.54) BRD4SLC6A9KCNH2
SCHEMBL5041633 0.73 SLC6A9 (0.78) SLC6A9KCNH2
SCHEMBL2828648 0.73 SLC6A9 (0.53) BRD4SLC6A9KCNH2
SCHEMBL29953902 0.72 PTGDR2 (0.41)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230128975-A1 PROCESS FOR THE PREPARATION OF BROMODOMAIN INHIBITOR CELGENE QUANTICEL RESEARCH, INC. (US) 2023-04-27 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 (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-20230128975-A1 PROCESS FOR THE PREPARATION OF BROMODOMAIN INHIBITOR BRD1, BRD4, BRD3 BRD4 2/4885SLC6A9 4633/4885KCNH2 2798/4885

“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.