SCHEMBL5089734

SCHEMBL5089734

CN1CCN(c2cccc(C(=O)Nc3cnc4[nH]cc(C=C5N=C(NC6CCCCC6)NC5=O)c4c3)c2)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 7/20 0.42
▸ CLK1 P49759 4/20 0.42
▸ MAPK14 Q16539 10/20 0.39
▸ GSK3B P49841 5/20 0.37
▸ WNT1 P04628 2/20 0.37
▸ DYRK3 O43781 4/20 0.36
▸ DYRK2 Q92630 4/20 0.36
▸ DYRK1B Q9Y463 4/20 0.36
▸ CLK2 P49760 3/20 0.36
▸ CLK3 P49761 3/20 0.36
▸ CLK4 Q9HAZ1 3/20 0.36
▸ DYRK4 Q9NR20 2/20 0.36
▸ CSNK1E P49674 1/20 0.36
▸ AURKA O14965 1/20 0.36
▸ KDR P35968 1/20 0.36
▸ FLT3 P36888 1/20 0.36
▸ TP53BP1 Q12888 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ HTR1B P28222 1/20 0.36
▸ HTR2A P28223 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
SCHEMBL5089729 1.00 DYRK1A (0.42) DYRK1ACLK1MAPK14GSK3BWNT1
SCHEMBL5095408 0.92 DYRK1A (0.50) DYRK1ACLK1MAPK14GSK3BDYRK3
SCHEMBL5095406 0.92 DYRK1A (0.50) DYRK1ACLK1MAPK14GSK3BDYRK3
SCHEMBL5100717 0.88 DYRK1A (0.40) DYRK1ACLK1MAPK14GSK3BWNT1
SCHEMBL5100722 0.88 DYRK1A (0.40) DYRK1ACLK1MAPK14GSK3BWNT1
SCHEMBL5094578 0.86 DYRK1A (0.43) DYRK1ACLK1MAPK14GSK3BWNT1
SCHEMBL5094580 0.86 DYRK1A (0.43) DYRK1ACLK1MAPK14GSK3BWNT1
SCHEMBL5095257 0.85 DYRK1A (0.42) DYRK1ACLK1MAPK14GSK3BWNT1
SCHEMBL5095254 0.85 DYRK1A (0.42) DYRK1ACLK1MAPK14GSK3BWNT1
SCHEMBL5089609 0.84 DYRK1A (0.46) DYRK1ACLK1MAPK14GSK3BWNT1

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
US-7371862-B2 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2008-05-13 — — US claimed
US-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2007-05-17 — — US claimed
US-7371862-B2 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2008-05-13 — — US disclosed
US-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PHARMACIA ITALIA S.P.A. (IT) 2007-05-17 — — 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-20070112020-A1 Azaindolylidene derivatives as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them MAP3K20, MAP3K6, MAP3K1 DYRK1A 308/4885CLK1 430/4885MAPK14 106/4885

“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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