SCHEMBL6195016

SCHEMBL6195016

NC(=O)c1n[nH]c2ccc(I)cc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 2/20 0.44
▸ NTRK1 P04629 1/20 0.44
▸ WNT1 P04628 1/20 0.44
▸ CLK2 P49760 1/20 0.44
▸ CLK3 P49761 1/20 0.44
▸ MAP2K4 P45985 3/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ MAPKAPK2 P49137 1/20 0.41
▸ MAPKAPK3 Q16644 1/20 0.41
▸ MAPK6 Q16659 1/20 0.41
▸ MAPKAPK5 Q8IW41 1/20 0.41
▸ JAK2 O60674 6/20 0.41
▸ JAK1 P23458 5/20 0.41
▸ TYK2 P29597 1/20 0.41
▸ JAK3 P52333 1/20 0.41
▸ PRKAG1 P54619 1/20 0.40
▸ PRKAA1 Q13131 1/20 0.40
▸ PRKAB1 Q9Y478 1/20 0.40
▸ HAO1 Q9UJM8 1/20 0.40
▸ LRRK2 Q5S007 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
SCHEMBL953396 0.85 PRKAG1 (0.55) PRKAG1PRKAA1PRKAB1HAO1
SCHEMBL23368472 0.83 GSK3B (0.47) DYRK1ANTRK1WNT1CLK2CLK3
SCHEMBL8877161 0.81 JAK2 (0.54) DYRK1ANTRK1WNT1CLK2CLK3
SCHEMBL17039120 0.80 JAK2 (0.64) DYRK1ANTRK1WNT1CLK2CLK3
SCHEMBL28575862 0.80 NTRK1 (0.58) DYRK1ANTRK1WNT1CLK2CLK3
SCHEMBL16246796 0.80 JAK2 (0.48) DYRK1ANTRK1WNT1CLK2CLK3
SCHEMBL15942818 0.80 MAP2K4 (0.62) DYRK1ANTRK1WNT1CLK2CLK3
SCHEMBL1141823 0.80 KDM4E (0.63) DYRK1ANTRK1CLK2PRKAG1PRKAA1
SCHEMBL4295771 0.80 CDC7 (0.47) DYRK1AWNT1CLK2CLK3MAPK1
SCHEMBL19001429 0.80 YTHDC1 (0.63) DYRK1ANTRK1JAK2JAK1TYK2

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
EP-1534685-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS Astex Technology Limited (GB) 2005-06-01 — — EP disclosed
WO-2004014864-A1 1H-INDAZOLE-3-CARBOXAMIDE COMPOUNDS AS CYCLIN DEPENDENT KINASES (CDK) INHIBITORS ASTEX TECHNOLOGY LIMITED (GB) 2004-02-19 — — WO disclosed
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