SCHEMBL17830702

SCHEMBL17830702

O=C(O)CCN1C(=O)/C(=C2/C(=O)N(CC(=O)OCc3cccc(C(F)(F)F)c3)c3ccc(Cl)cc32)SC1=S

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
APEX1 P27695 4/20 0.51
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
CTDSP1 Q9GZU7 3/20 0.49
CCR6 P51684 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
PTPN7 P35236 2/20 0.47
CACNA1B Q00975 2/20 0.47
APBA1 Q02410 2/20 0.47
PTPN22 Q9Y2R2 2/20 0.47
DUSP3 P51452 1/20 0.47
PTPN12 Q05209 1/20 0.47
APOBEC3G Q9HC16 1/20 0.46
KAT2B Q92831 5/20 0.43
PTGES O14684 1/20 0.43
CREBBP Q92793 4/20 0.42
KAT2A Q92830 4/20 0.42
EP300 Q09472 3/20 0.42

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
SCHEMBL17830697 0.92 APEX1 (0.51) APEX1MEN1KMT2ACTDSP1CCR6
SCHEMBL17830698 0.92 APEX1 (0.57) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17830700 0.90 MEN1 (0.55) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17830705 0.90 APEX1 (0.61) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17830696 0.89 APEX1 (0.54) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17832352 0.88 APEX1 (0.57) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17830694 0.87 PTPN7 (0.56) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17830699 0.86 MEN1 (0.61) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17830695 0.85 KAT2B (0.54) APEX1MEN1KMT2ACTDSP1PTPN7
SCHEMBL17830693 0.83 PTPN7 (0.60) APEX1MEN1KMT2ACTDSP1PTPN7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9943506-B2 BCL6 inhibitors as anticancer agents CORNELL UNIVERSITY (US) 2018-04-17 US disclosed
US-9943506-B2 BCL6 inhibitors as anticancer agents CORNELL UNIVERSITY (US) 2018-04-17 US disclosed
US-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS CORNELL UNIVERSITY 2016-06-16 US disclosed
US-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS CORNELL UNIVERSITY 2016-06-16 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-20160166549-A1 BCL6 INHIBITORS AS ANTICANCER AGENTS BCL6, BCL6B, BAZ2A APEX1 3100/4885MEN1 3321/4885KMT2A 1188/4885

“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.