SCHEMBL2395253

SCHEMBL2395253

Cc1cccc(-c2n[nH]c3cnc4ccc(-c5cncc(N6CCCC6)c5)cc4c23)c1

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 9/20 0.46
▸ WNT1 P04628 8/20 0.46
▸ PIM1 P11309 5/20 0.43
▸ LRRK2 Q5S007 1/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.40
▸ MAP4K1 Q92918 1/20 0.39
▸ MAPKAPK2 P49137 1/20 0.39
▸ CLK2 P49760 1/20 0.39
▸ CLK3 P49761 1/20 0.39

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
SCHEMBL2397113 0.89 LRRK2 (0.47) DYRK1AWNT1PIM1LRRK2MAPKAPK2
SCHEMBL2398394 0.81 DYRK1A (0.47) DYRK1AWNT1PIM1LRRK2CLK2
SCHEMBL2398692 0.78 CNR2 (0.48) PIM1LRRK2
SCHEMBL1559214 0.75 MAPK10 (0.46) LRRK2MAPKAPK2
SCHEMBL2397132 0.75 DYRK1A (0.44) DYRK1AWNT1LRRK2MAP4K1CLK2
SCHEMBL1558709 0.74 NPBWR1 (0.46) —
SCHEMBL2400727 0.74 LRRK2 (0.48) DYRK1AWNT1LRRK2IRAK4CLK2
SCHEMBL2396513 0.74 LRRK2 (0.53) PIM1LRRK2MAP4K1
SCHEMBL2398645 0.74 LRRK2 (0.42) DYRK1AWNT1LRRK2CLK2CLK3
SCHEMBL1559133 0.73 MAP3K5 (0.40) PIM1LRRK2

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 1 patent. 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

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 DYRK1A 360/4885WNT1 1222/4885PIM1 417/4885

“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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