SCHEMBL2294262

SCHEMBL2294262

O=C(CON=C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)Nc1ccccn1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.47
LMNA P02545 4/20 0.47
ALDH1A1 P00352 2/20 0.47
GAA P10253 2/20 0.47
KMT2A Q03164 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
MAPT P10636 1/20 0.47
HSD17B10 Q99714 1/20 0.47
TSHR P16473 3/20 0.47
HTT P42858 2/20 0.47
HSD11B1 P28845 1/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
KDM4E B2RXH2 1/20 0.43

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
SCHEMBL2295153 0.90 L3MBTL1 (0.46) L3MBTL1LMNAALDH1A1GAAKMT2A
SCHEMBL2294488 0.87 L3MBTL1 (0.49) L3MBTL1LMNAALDH1A1GAASMN1; SMN2
SCHEMBL2295174 0.87 LMNA (0.58) LMNAALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL2292814 0.87 ALDH1A1 (0.46) L3MBTL1LMNAALDH1A1GAAKMT2A
SCHEMBL2290350 0.86 LMNA (0.53) L3MBTL1LMNAALDH1A1GAAKMT2A
SCHEMBL2292040 0.85 NPC1 (0.49) L3MBTL1LMNAALDH1A1GAAKMT2A
SCHEMBL2296255 0.84 ALDH1A1 (0.54) L3MBTL1LMNAALDH1A1GAAKMT2A
SCHEMBL2292064 0.84 KMT2A (0.50) L3MBTL1LMNAALDH1A1GAAKMT2A
SCHEMBL2291103 0.83 KMT2A (0.56) LMNAALDH1A1GAAKMT2ASMN1; SMN2
SCHEMBL2296045 0.83 LMNA (0.52) L3MBTL1LMNAALDH1A1GAAKMT2A

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 L3MBTL1 2561/4885LMNA 2476/4885ALDH1A1 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.