SCHEMBL2294367

SCHEMBL2294367

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

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.46
MEN1 O00255 1/20 0.46
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.45
GAA P10253 3/20 0.45
ALDH1A1 P00352 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 1/20 0.45
PKM P14618 3/20 0.45
HSD17B10 Q99714 1/20 0.45
CNR1 P21554 1/20 0.45
PKLR P30613 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
SCHEMBL2296022 0.93 KMT2A (0.45) KMT2AMEN1LMNAHTTGAA
SCHEMBL2292597 0.91 KMT2A (0.46) KMT2AMEN1LMNAHTTGAA
SCHEMBL2291059 0.90 KMT2A (0.43) KMT2AMEN1LMNAHTTGAA
SCHEMBL2296185 0.90 KMT2A (0.46) KMT2AMEN1LMNAHTTGAA
SCHEMBL12419494 0.89 KMT2A (0.45) KMT2AMEN1LMNAHTTGAA
SCHEMBL2296261 0.89 PKM (0.47) KMT2AMEN1LMNAHTTGAA
SCHEMBL2297393 0.88 LMNA (0.52) KMT2AMEN1LMNAHTTGAA
SCHEMBL2290476 0.88 SMN1; SMN2 (0.48) KMT2AMEN1LMNAHTTGAA
SCHEMBL2296959 0.88 PKM (0.48) KMT2AMEN1LMNAHTTGAA
SCHEMBL2293411 0.88 KMT2A (0.44) KMT2AMEN1LMNAHTTGAA

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 5 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
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 2564/4885MEN1 3484/4885LMNA 2476/4885

“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.