SCHEMBL2295296

SCHEMBL2295296

O=C(CON=C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)NCc1ccncc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 4/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 1/20 0.48
RORC P51449 1/20 0.45
MEN1 O00255 1/20 0.45
LMNA P02545 1/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.42
HTT P42858 1/20 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
SCHEMBL2297393 0.92 LMNA (0.52) KMT2AALDH1A1MEN1LMNAGAA
SCHEMBL2293920 0.91 NAMPT (0.51) NAMPTKMT2AALDH1A1MEN1LMNA
SCHEMBL2291154 0.91 MEN1 (0.50) KMT2AALDH1A1MEN1LMNAGAA
SCHEMBL2290518 0.88 KMT2A (0.47) NAMPTKMT2AALDH1A1MEN1LMNA
SCHEMBL2290350 0.88 LMNA (0.53) NAMPTKMT2AALDH1A1MEN1LMNA
SCHEMBL2292207 0.87 KMT2A (0.46) KMT2AMEN1LMNAGAA
SCHEMBL2292814 0.87 ALDH1A1 (0.46) KMT2AALDH1A1MEN1LMNAGAA
SCHEMBL2291401 0.86 KMT2A (0.51) KMT2AALDH1A1LMNAGAA
SCHEMBL2294367 0.86 KMT2A (0.46) KMT2AALDH1A1MEN1LMNAGAA
SCHEMBL2292597 0.86 KMT2A (0.46) KMT2AALDH1A1MEN1LMNAGAA

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 NAMPT 2024/4885KMT2A 2564/4885ALDH1A1 1349/4885

“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.