SCHEMBL5139697

SCHEMBL5139697

N#Cc1c(N)nc2cnccc2c1CCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.41
GAA P10253 2/20 0.41
GLA P06280 1/20 0.41
PIP4K2A P48426 3/20 0.41
RXFP1 Q9HBX9 2/20 0.39
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
ADORA2A P29274 2/20 0.38
ADORA1 P30542 2/20 0.38
LATS1 O95835 1/20 0.37
LATS2 Q9NRM7 1/20 0.37
HTT P42858 2/20 0.37
KDM4C Q9H3R0 1/20 0.37
CLK1 P49759 1/20 0.36
IKBKB O14920 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL6071945 0.87 ALDH1A1 (0.49) KDM4EGAARXFP1ALDH1A1MEN1
SCHEMBL6072069 0.74 KDM4E (0.50) KDM4EGAAGLARXFP1ALDH1A1
SCHEMBL5139696 0.72 RXFP1 (0.41) KDM4EGAAGLAPIP4K2ARXFP1
SCHEMBL6071926 0.71 ALDH1A1 (0.46) KDM4EGAARXFP1ALDH1A1MEN1
SCHEMBL12733976 0.71 CLK1 (0.43) LATS1LATS2KDM4CCLK1
SCHEMBL6265005 0.70 TLR8 (0.64) KDM4EGAAGLAALDH1A1NPSR1
SCHEMBL5138974 0.70 KDM4E (0.53) KDM4EGAAGLAPIP4K2ARXFP1
SCHEMBL5948603 0.69 PIP4K2A (0.40) KDM4EGAAGLAPIP4K2ARXFP1
SCHEMBL27975057 0.69 MEN1 (0.49) KDM4ERXFP1ALDH1A1MEN1KMT2A
SCHEMBL11373679 0.69 TLR8 (0.41) KDM4EALDH1A1ADORA2AADORA1CLK1

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-7432279-B2 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2008-10-07 US disclosed
US-20060276498-A1 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same WYETH (US) 2006-12-07 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-20060276498-A1 4,6-diamino-[1,7]naphthyridine-3-carbonitrile inhibitors of Tpl2 kinase and methods of making and using the same TNNI3K, CNKSR1, DTYMK KDM4E 1953/4885GAA 3899/4885GLA 3369/4885

“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.