SCHEMBL1624062

SCHEMBL1624062

N#Cc1c(C2CCNCC2)cc(Cl)nc1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ IKBKB O14920 12/20 0.46
▸ CHUK O15111 1/20 0.38
▸ PLAT P00750 2/20 0.36
▸ TLR9 Q9NR96 1/20 0.36
▸ TLR8 Q9NR97 1/20 0.36
▸ TLR7 Q9NYK1 1/20 0.36
▸ NSD2 O96028 1/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ APP P05067 1/20 0.34
▸ HRH4 Q9H3N8 1/20 0.33
▸ CHRNB4 P30926 1/20 0.33
▸ CHRNA3 P32297 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ RAB9A P51151 1/20 0.33

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
SCHEMBL1623755 0.89 NSD2 (0.39) IKBKBNSD2MAPK1
SCHEMBL14301889 0.74 AURKA (0.43) —
SCHEMBL17225065 0.73 KDM4E (0.37) IKBKBMAPK1
SCHEMBL1623292 0.69 GPR119 (0.48) NSD2
SCHEMBL15602523 0.68 SLC18A3 (0.47) TLR9TLR8TLR7HRH4NPC1
SCHEMBL30402943 0.67 L3MBTL1 (0.40) NSD2MAPK1
SCHEMBL28287225 0.67 L3MBTL1 (0.40) NSD2MAPK1
SCHEMBL21590196 0.66 NOS2 (0.50) IKBKB
SCHEMBL15407930 0.65 IKBKB (0.39) IKBKBCHUKHRH4CHRNB4CHRNA3
SCHEMBL8401200 0.64 L3MBTL1 (0.49) IKBKBNPC1RAB9A

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
EP-1876178-B1 CYANOPYRIDINE DERIVATIVE AND USE THEREOF AS MEDICINE MITSUBISHI TANABE PHARMA CORP (JP) 2015-05-27 — — EP disclosed
US-7928126-B2 Cyanopyridine derivative and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-04-19 — — US disclosed
US-20090292121-A1 Cyanopyridine derivative and use thereof as medicine MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-11-26 — — US disclosed
EP-1876178-A1 CYANOPYRIDINE DERIVATIVE AND USE THEREOF AS MEDICINE Mitsubishi Tanabe Pharma Corporation (JP) 2008-01-09 — — EP 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-20090292121-A1 Cyanopyridine derivative and use thereof as medicine DPYD, IDH1, TP53 IKBKB 2286/4885CHUK 1230/4885PLAT 3203/4885

“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.

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