SCHEMBL2397747

SCHEMBL2397747

CC(=O)Nc1cncc(-c2ccc3ncc4[nH]nc(-c5ccncc5)c4c3c2)c1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CLK2 P49760 13/20 0.51
▸ CLK3 P49761 12/20 0.51
▸ DYRK1A Q13627 12/20 0.51
▸ MAPK10 P53779 1/20 0.47
▸ WNT1 P04628 4/20 0.47
▸ TTK P33981 1/20 0.46
▸ MAPK8 P45983 1/20 0.46
▸ NTRK1 P04629 1/20 0.44

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
SCHEMBL2399375 0.94 TTK (0.50) CLK2CLK3DYRK1AMAPK10WNT1
SCHEMBL2396969 0.89 CHEK1 (0.42) CLK2CLK3DYRK1AMAPK10TTK
SCHEMBL1558650 0.87 MTOR (0.49) CLK2CLK3DYRK1AWNT1TTK
SCHEMBL2396580 0.85 MAPK10 (0.44) CLK2CLK3DYRK1AMAPK10
SCHEMBL1557469 0.79 CLK2 (0.51) CLK2CLK3DYRK1AWNT1
SCHEMBL1557578 0.79 RAF1 (0.51) CLK2CLK3DYRK1AMAPK10NTRK1
SCHEMBL2395780 0.77 DYRK1A (0.48) CLK2CLK3DYRK1AWNT1
SCHEMBL2396806 0.77 CLK2 (0.50) CLK2CLK3DYRK1AWNT1
SCHEMBL2396769 0.77 MTOR (0.42) CLK2CLK3DYRK1AWNT1
SCHEMBL1559106 0.77 MTOR (0.50) DYRK1ATTKMAPK8

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-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
US-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. 2011-09-01 — — US disclosed
WO-2009155527-A9 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2010-05-06 — — WO disclosed
WO-2009155527-A2 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PROGENICS PHARMACEUTICALS, INC. (US) 2009-12-23 — — 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-20110212053-A1 PHOSPHATIDYLINOSITOL 3 KINASE INHIBITORS PIK3CA, AKT1, PIK3R5 CLK2 408/4885CLK3 506/4885DYRK1A 360/4885

“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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