SCHEMBL18487482

SCHEMBL18487482

C=C(CC(C)(C)C)Nc1cncc(-c2ccc3[nH]nc(-c4cc5ccccc5[nH]4)c3c2)c1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CLK2 P49760 16/20 0.59
▸ CLK3 P49761 16/20 0.59
▸ DYRK1A Q13627 16/20 0.59
▸ WNT1 P04628 2/20 0.57
▸ ITK Q08881 2/20 0.51

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
SCHEMBL18485356 0.91 CLK2 (0.65) CLK2CLK3DYRK1AWNT1
SCHEMBL18488102 0.90 CLK2 (0.65) CLK2CLK3DYRK1AITK
SCHEMBL18446253 0.90 WNT1 (0.70) CLK2CLK3DYRK1AWNT1ITK
SCHEMBL18484683 0.90 CLK2 (0.51) CLK2CLK3DYRK1AWNT1ITK
SCHEMBL18494677 0.88 CLK2 (0.69) CLK2CLK3DYRK1AWNT1
SCHEMBL18487109 0.87 CLK2 (0.71) CLK2CLK3DYRK1AWNT1ITK
SCHEMBL18489999 0.86 CLK3 (0.70) CLK2CLK3DYRK1AWNT1
SCHEMBL18447282 0.85 CLK2 (0.68) CLK2CLK3DYRK1AWNT1ITK
SCHEMBL18484733 0.84 CLK3 (0.58) CLK2CLK3DYRK1AWNT1
SCHEMBL18487120 0.84 CLK2 (0.61) CLK2CLK3DYRK1AWNT1ITK

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
WO-2017023986-A1 3-(1H-INDOL-2-YL)-1H-INDAZOLES AND THERAPEUTIC USES THEREOF SAMUMED, LLC (US) 2017-02-09 — — WO disclosed
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