SCHEMBL5042792

SCHEMBL5042792

CN1CC2CC1CN2C(=O)c1n[nH]c2ccc(-c3ccccc3)cc12

nearest known ligand 0.56

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 16/20 0.56
▸ GSK3B P49841 3/20 0.49
▸ WNT1 P04628 9/20 0.45
▸ CLK2 P49760 1/20 0.45
▸ CLK3 P49761 1/20 0.45
▸ PRKAG1 P54619 1/20 0.45
▸ PRKAA1 Q13131 1/20 0.45
▸ PRKAB1 Q9Y478 1/20 0.45
▸ JAK2 O60674 1/20 0.44
▸ AXL P30530 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
SCHEMBL1176610 1.00 DYRK1A (0.56) DYRK1AGSK3BWNT1CLK2CLK3
Formic Acid SCHEMBL5563457 0.96 DYRK1A (0.52) DYRK1AGSK3BWNT1CLK2CLK3
SCHEMBL1175586 0.91 DYRK1A (0.56) DYRK1AGSK3BWNT1
SCHEMBL5042846 0.91 DYRK1A (0.56) DYRK1AGSK3BWNT1
SCHEMBL5046313 0.90 DYRK1A (0.58) DYRK1AGSK3BWNT1
SCHEMBL1176384 0.90 DYRK1A (0.58) DYRK1AGSK3BWNT1
SCHEMBL5046474 0.89 PRKAG1 (0.58) DYRK1AGSK3BCLK2PRKAG1PRKAA1
SCHEMBL1176665 0.89 PRKAG1 (0.58) DYRK1AGSK3BCLK2PRKAG1PRKAA1
SCHEMBL5048444 0.89 PRKAG1 (0.58) DYRK1AGSK3BCLK2PRKAG1PRKAA1
Formic Acid SCHEMBL5557042 0.87 DYRK1A (0.53) DYRK1AGSK3BWNT1

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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