SCHEMBL16425752

SCHEMBL16425752

O=S(=O)(Nc1cc(Cl)c(O)c2ccccc12)c1ccc(Br)c(Br)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EP300 Q09472 2/20 0.77
BRAF P15056 2/20 0.57
HSD11B1 P28845 1/20 0.55
MCL1 Q07820 5/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
HSP90AA1 P07900 1/20 0.49
ADAM17 P78536 1/20 0.49
KLF5 Q13887 1/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
HPGD P15428 1/20 0.49
ALOX15 P16050 1/20 0.49
HSD17B10 Q99714 1/20 0.49
BCL2 P10415 2/20 0.48
BCL2L1 Q07817 2/20 0.48
DNMT1 P26358 1/20 0.48
DNMT3A Q9Y6K1 1/20 0.48

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
SCHEMBL13510524 0.89 EP300 (0.72) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510387 0.87 EP300 (1.00) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510523 0.86 EP300 (0.67) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510519 0.85 EP300 (0.77) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510382 0.84 EP300 (0.80) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510376 0.84 EP300 (0.80) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510381 0.83 EP300 (0.70) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510421 0.82 EP300 (0.69) EP300BRAFHSD11B1MEN1KMT2A
SCHEMBL13510452 0.82 EP300 (0.69) EP300BRAFHSD11B1MCL1MEN1
SCHEMBL13510521 0.82 EP300 (0.68) EP300BRAFHSD11B1MCL1MEN1

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-20150031714-A1 METHODS AND COMPOSITIONS FOR PREVENTION OF ALLERGIC REACTION BAYLOR COLLEGE OF MEDICINE 2015-01-29 US disclosed
US-20150031714-A1 METHODS AND COMPOSITIONS FOR PREVENTION OF ALLERGIC REACTION BAYLOR COLLEGE OF MEDICINE 2015-01-29 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-20150031714-A1 METHODS AND COMPOSITIONS FOR PREVENTION OF ALLERGIC REACTION JAK2, STAT3, STAT6 EP300 95/4885BRAF 1379/4885HSD11B1 1764/4885

“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.