SCHEMBL5038892

SCHEMBL5038892

Cc1ccc(-c2ccc3[nH]nc(C(=O)N4CC5CC4CN5C)c3c2)s1

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 20/20 0.41
▸ GSK3B P49841 13/20 0.41
▸ CLK2 P49760 3/20 0.40
▸ CLK3 P49761 3/20 0.40
▸ WNT1 P04628 3/20 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
SCHEMBL1175540 1.00 DYRK1A (0.41) DYRK1AGSK3BCLK2CLK3WNT1
Formic Acid SCHEMBL5562289 0.96 DYRK1A (0.39) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL1176152 0.93 JAK2 (0.38) DYRK1AGSK3BCLK2CLK3
SCHEMBL5039448 0.93 JAK2 (0.38) DYRK1AGSK3BCLK2CLK3
Formic Acid SCHEMBL5563840 0.90 JAK2 (0.36) DYRK1AGSK3BCLK2CLK3
SCHEMBL1175956 0.89 DYRK1A (0.41) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL1176539 0.87 DYRK1A (0.40) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL5046675 0.87 DYRK1A (0.40) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL1176398 0.86 DYRK1A (0.48) DYRK1AGSK3BCLK2CLK3WNT1
SCHEMBL5043123 0.86 DYRK1A (0.48) DYRK1AGSK3BCLK2CLK3WNT1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7396833-B2 Indoles, 1H-indazoles, 1,2-benzisoxazoles, and 1,2-benzisothiazoles, and preparation and uses thereof MEMORY PHARMACEUTICALS CORPORATION (US) 2008-07-08 — — US claimed
EP-1697378-B1 INDOLES, 1H-INDAZOLES, 1,2-BENZISOXAZOLES, AND 1,2-BENZISOTHIAZOLES, AND PREPARATION AND USES THEREOF MEMORY PHARM CORP (US) 2007-11-21 — — EP claimed
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