SCHEMBL2297161

SCHEMBL2297161

O=C(Nc1ccc2ccccc2n1)ON=C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.46
MAPT P10636 4/20 0.45
TP53 P04637 1/20 0.45
PHGDH O43175 1/20 0.45
ALDH1A1 P00352 2/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
GBA1 P04062 2/20 0.43
HTT P42858 2/20 0.43
CYP2C9 P11712 1/20 0.43
LMNA P02545 5/20 0.43
GAA P10253 2/20 0.42
HSD17B10 Q99714 1/20 0.41
CNR1 P21554 1/20 0.41

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
SCHEMBL2295289 0.86 L3MBTL1 (0.49) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL2294488 0.85 L3MBTL1 (0.49) L3MBTL1ALDH1A1SMN1; SMN2HTTCYP2C9
SCHEMBL2292731 0.85 TRPV1 (0.49) L3MBTL1MAPTALDH1A1KMT2ASMN1; SMN2
SCHEMBL2291074 0.84 LMNA (0.53) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL2297446 0.83 KMT2A (0.51) L3MBTL1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL2289836 0.81 EPHX2 (0.47) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL2292594 0.81 ALDH1A1 (0.52) ALDH1A1HTTCYP2C9LMNAGAA
SCHEMBL2292379 0.81 TSHR (0.50) MAPTTP53ALDH1A1MEN1KMT2A
SCHEMBL2294864 0.80 NPC1 (0.52) L3MBTL1MAPTALDH1A1MEN1KMT2A
SCHEMBL2292202 0.80 MEN1 (0.50) MAPTTP53ALDH1A1MEN1KMT2A

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 2 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

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 2561/4885MAPT 2931/4885TP53 3879/4885

“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.