SCHEMBL6534005

SCHEMBL6534005

CNS(=O)(=O)Cc1ccc(NC(=O)c2n[nH]c3ccc(I)cc23)cc1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 4/20 0.48
DYRK1A Q13627 9/20 0.46
WNT1 P04628 5/20 0.46
FLT3 P36888 5/20 0.46
CDK2 P24941 3/20 0.45
GSK3B P49841 2/20 0.44
CLK2 P49760 1/20 0.44
CLK3 P49761 1/20 0.44
CCNA2 P20248 1/20 0.44
CCNA1 P78396 1/20 0.44
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43

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
SCHEMBL5945648 0.81 FLT3 (0.50) CSNK2A1DYRK1AWNT1FLT3CDK2
SCHEMBL5945720 0.79 CDK2 (0.71) CSNK2A1DYRK1AWNT1FLT3CDK2
SCHEMBL5945808 0.78 FLT3 (0.70) CSNK2A1DYRK1AFLT3CDK2GSK3B
SCHEMBL4520668 0.78 FLT3 (0.55) CSNK2A1DYRK1AWNT1FLT3CDK2
SCHEMBL19001429 0.75 YTHDC1 (0.63) DYRK1AFLT3CDK2CCNA2CCNA1
SCHEMBL5945641 0.75 FLT3 (0.48) CSNK2A1DYRK1AWNT1FLT3CDK2
SCHEMBL5945662 0.74 CSNK2A1 (0.76) CSNK2A1DYRK1AWNT1FLT3CDK2
SCHEMBL5945670 0.71 DYRK1A (0.65) DYRK1AWNT1FLT3CDK2CLK2
SCHEMBL4521580 0.70 DYRK1A (0.52) CSNK2A1DYRK1AWNT1FLT3CDK2
SCHEMBL5525195 0.69 SMN1; SMN2 (0.53) DYRK1AWNT1GSK3BNPC1

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-2005014554-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS MAPKAP KINASE MODULATORS ASTEX THERAPEUTICS LIMITED (GB) 2005-02-17 WO disclosed