SCHEMBL2808569

SCHEMBL2808569

N#Cc1cccc(/C=N/OC2CCN(S(=O)(=O)c3ccc(OC(F)(F)F)cc3)CC2)c1

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 5/20 0.45
KMT2A Q03164 5/20 0.45
EPHX2 P34913 3/20 0.44
GPR6 P46095 1/20 0.43
LIPE Q05469 1/20 0.42
SFRP1 Q8N474 1/20 0.41
TP53 P04637 1/20 0.41
EPHX1 P07099 2/20 0.40
CCR6 P51684 1/20 0.39
MMP2 P08253 1/20 0.38
MMP13 P45452 1/20 0.38
RORC P51449 1/20 0.38
FPR2 P25090 1/20 0.37
PROKR1 Q8TCW9 1/20 0.37

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
SCHEMBL2808573 1.00 MEN1 (0.45) MEN1KMT2AEPHX2GPR6LIPE
SCHEMBL3636331 0.87 ADAM17 (0.38) MEN1KMT2AEPHX2GPR6LIPE
SCHEMBL13167738 0.86 P4HB (0.41) EPHX2SFRP1CCR6RORC
SCHEMBL13130722 0.84 EPHX2 (0.44) MEN1KMT2AEPHX2LIPETP53
SCHEMBL2811085 0.81 MEN1 (0.44) MEN1KMT2AEPHX2GPR6LIPE
SCHEMBL2811084 0.81 MEN1 (0.44) MEN1KMT2AEPHX2GPR6LIPE
SCHEMBL2811082 0.81 MEN1 (0.44) MEN1KMT2AEPHX2GPR6LIPE
SCHEMBL2810663 0.80 EPHX2 (0.44) MEN1KMT2AEPHX2GPR6LIPE
SCHEMBL8118131 0.80 EPHX2 (0.44) MEN1KMT2AEPHX2GPR6LIPE
SCHEMBL2810661 0.80 EPHX2 (0.44) MEN1KMT2AEPHX2GPR6LIPE

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8563732-B2 Oxyimino compounds and the use thereof SHIONOGI & CO., LTD. (JP) 2013-10-22 US disclosed
US-8563732-B2 Oxyimino compounds and the use thereof SHIONOGI & CO., LTD. (JP) 2013-10-22 US disclosed
EP-2164325-B1 OXYIMINO COMPOUNDS AND THE USE THEREOF SHIONOGI & CO (JP) 2013-04-24 EP disclosed
EP-2164325-B1 OXYIMINO COMPOUNDS AND THE USE THEREOF SHIONOGI & CO (JP) 2013-04-24 EP disclosed
US-20100240703-A1 OXYIMINO COMPOUNDS AND THE USE THEREOF PURDUE PHARMA L.P. 2010-09-23 US disclosed
EP-2164325-A1 OXYIMINO COMPOUNDS AND THE USE THEREOF Shionogi&Co., Ltd. (JP) 2010-03-24 EP disclosed
WO-2008150470-A1 OXYIMINO COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 2008-12-11 WO disclosed
WO-2008150470-A1 OXYIMINO COMPOUNDS AND THE USE THEREOF SHIONOGI & CO., LTD. (JP) 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-20100240703-A1 OXYIMINO COMPOUNDS AND THE USE THEREOF CACNA1A, CACNA1S, OPRM1 MEN1 2609/4885KMT2A 2355/4885EPHX2 653/4885

“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.