SCHEMBL2289643

SCHEMBL2289643

N#Cc1cccc(C(ON=C2CCN(S(=O)(=O)c3ccc(OC(F)(F)F)cc3)CC2)C(=O)N2CCOCC2)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
GPR6 P46095 1/20 0.38
ALB P02768 1/20 0.38
AKR1C3 P42330 1/20 0.37
PKM P14618 2/20 0.36
MAPT P10636 1/20 0.35
SCN9A Q15858 2/20 0.35
CYP2C9 P11712 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL3638771 0.89 KMT2A (0.36) MEN1KMT2AGPR6MAPT
SCHEMBL12420246 0.89 ALB (0.42) ALBPKMCYP2C9
SCHEMBL4393229 0.84 MEN1 (0.39) MEN1KMT2AGPR6LMNA
SCHEMBL4379436 0.82 MEN1 (0.43) MEN1KMT2AGPR6AKR1C3SCN9A
SCHEMBL4382730 0.80 MEN1 (0.42) MEN1KMT2AGPR6AKR1C3CYP2C9
SCHEMBL8223748 0.80 GPR6 (0.38) MEN1KMT2AGPR6AKR1C3SCN9A
SCHEMBL4379541 0.79 MEN1 (0.41) MEN1KMT2AGPR6AKR1C3MAPT
SCHEMBL4382938 0.79 MEN1 (0.41) MEN1KMT2AGPR6AKR1C3SCN9A
SCHEMBL4395257 0.78 CYP11B1 (0.43) MEN1KMT2AGPR6AKR1C3LMNA
SCHEMBL4386294 0.78 MEN1 (0.40) MEN1KMT2AGPR6AKR1C3MAPT

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 MEN1 3484/4885KMT2A 2564/4885GPR6 532/4885

“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.