SCHEMBL2291401

SCHEMBL2291401

COc1cccc(CNC(=O)CON=C2CCN(S(=O)(=O)c3cccc(C(F)(F)F)c3)CC2)c1

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
NPC1 O15118 1/20 0.51
APOBEC3A P31941 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
PKM P14618 5/20 0.50
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
GAA P10253 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL2292207 0.90 KMT2A (0.46) KMT2APKMLMNAGAAL3MBTL1
SCHEMBL2297393 0.90 LMNA (0.52) KMT2APKMLMNAALDH1A1GAA
SCHEMBL2290518 0.89 KMT2A (0.47) KMT2APKMLMNAALDH1A1GAA
SCHEMBL2293660 0.87 ALDH1A1 (0.53) KMT2ALMNAALDH1A1GAAL3MBTL1
SCHEMBL2291154 0.87 MEN1 (0.50) KMT2ALMNAALDH1A1GAA
SCHEMBL2295296 0.86 NAMPT (0.48) KMT2ALMNAALDH1A1GAA
SCHEMBL2293920 0.85 NAMPT (0.51) KMT2ALMNAALDH1A1
SCHEMBL2292597 0.85 KMT2A (0.46) KMT2APKMLMNAALDH1A1GAA
SCHEMBL2290159 0.84 ALDH1A1 (0.56) KMT2ALMNAALDH1A1GAAL3MBTL1
SCHEMBL2292079 0.84 PKM (0.45) KMT2APKMLMNAALDH1A1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
US-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2011-08-04 US disclosed
EP-2164326-A1 AMIDE COMPOUNDS AND THE USE THEREOF Euro-Celtique, S.A. (LU) 2010-03-24 EP disclosed
WO-2008150447-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2008-12-11 WO disclosed
WO-2008150447-A1 AMIDE COMPOUNDS AND THE USE THEREOF EURO-CELTIQUE S.A. (LU) 2008-12-11 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-20110190300-A1 AMIDE COMPOUNDS AND THE USE THEREOF CACNA1E, CACNA1B, CACNA1S KMT2A 2564/4885NPC1 1113/4885APOBEC3A 3750/4885

“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.