SCHEMBL4960440

SCHEMBL4960440

CCOC(OCC)c1cn(CS(=O)(=O)N2CCOCC2)nn1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.44
MEN1 O00255 1/20 0.44
ALDH1A1 P00352 10/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
TSHR P16473 2/20 0.36
KDM4E B2RXH2 5/20 0.36
HSD17B10 Q99714 4/20 0.36
HPGD P15428 2/20 0.36
LMNA P02545 2/20 0.33
CASP1 P29466 1/20 0.33
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
USP2 O75604 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
GLA P06280 1/20 0.31

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
SCHEMBL18707079 0.71 MEN1 (0.52) KMT2AMEN1KDM4E
SCHEMBL27707437 0.69 KMT2A (0.35) KMT2AMEN1ALDH1A1HPGDLMNA
SCHEMBL7602303 0.64 CA12 (0.59) ALDH1A1SMN1; SMN2TSHRKDM4EHPGD
SCHEMBL18700890 0.64 MEN1 (0.44) KMT2AMEN1
SCHEMBL13242529 0.63 FLT3 (0.46) ALDH1A1SMN1; SMN2KDM4E
SCHEMBL18706997 0.61 MEN1 (0.42) KMT2AMEN1
SCHEMBL622633 0.61 MEN1 (0.42) KMT2AMEN1
SCHEMBL19732400 0.61 SMN1; SMN2 (0.48) KMT2AMEN1ALDH1A1SMN1; SMN2TSHR
SCHEMBL4962780 0.59 MEN1 (0.42) KMT2AMEN1ALDH1A1KDM4EHPGD
SCHEMBL28949984 0.59 MEN1 (0.46) KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101223143-A 3-cyanoquinoline inhibitors of TPL2 kinase and methods of making and using the same WYETH CORP (US) 2008-07-16 CN disclosed
EP-1888529-A2 3-CYANOQUINOLINE INHIBITORS OF TPL2 KINASE AND METHODS OF MAKING AND USING THE SAME Wyeth (US) 2008-02-20 EP disclosed
US-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2006-11-23 US disclosed
WO-2006124692-A2 3-CYANOQUINOLINE INHIBITORS OF TPL2 KINASE AND METHODS OF MAKING AND USING THE SAME WYETH (US) 2006-11-23 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-20060264460-A1 3-Cyanoquinoline inhibitors of Tpl2 kinase and methods of making and using the same TNNI3K, CSNK1A1L, CDKL1 KMT2A 1686/4885MEN1 3896/4885ALDH1A1 3975/4885

“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.