SCHEMBL2297393

SCHEMBL2297393

O=C(CON=C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)NCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
KMT2A Q03164 2/20 0.49
MEN1 O00255 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.48
HTT P42858 1/20 0.48
ALDH1A1 P00352 1/20 0.47
HSD17B10 Q99714 1/20 0.47
POLB P06746 1/20 0.46
GAA P10253 1/20 0.46
PLA2G1B P04054 1/20 0.45
PKM P14618 1/20 0.45
ATG4B Q9Y4P1 1/20 0.45

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
SCHEMBL2291154 0.93 MEN1 (0.50) LMNAKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL2295296 0.92 NAMPT (0.48) LMNAKMT2AMEN1HTTALDH1A1
SCHEMBL2290518 0.92 KMT2A (0.47) LMNAKMT2AMEN1HTTALDH1A1
SCHEMBL2292207 0.91 KMT2A (0.46) LMNAKMT2AMEN1GAAPLA2G1B
SCHEMBL3641286 0.91 ALDH1A1 (0.49) LMNAKMT2AMEN1HTTALDH1A1
SCHEMBL2293920 0.90 NAMPT (0.51) LMNAKMT2AMEN1ALDH1A1
SCHEMBL2291401 0.90 KMT2A (0.51) LMNAKMT2AALDH1A1GAAPKM
SCHEMBL2292597 0.88 KMT2A (0.46) LMNAKMT2AMEN1SMN1; SMN2HTT
SCHEMBL2294367 0.88 KMT2A (0.46) LMNAKMT2AMEN1SMN1; SMN2HTT
SCHEMBL2296185 0.87 KMT2A (0.46) LMNAKMT2AMEN1SMN1; SMN2HTT

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 LMNA 2476/4885KMT2A 2564/4885MEN1 3484/4885

“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.