SCHEMBL19263292

SCHEMBL19263292

OC(Cc1ccccc1)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6cccnc6)ccnc5[nH]4)c3c2)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
WNT1 P04628 10/20 0.60
CLK2 P49760 10/20 0.57
CLK3 P49761 10/20 0.57
DYRK1A Q13627 10/20 0.57
TGFBR1 P36897 1/20 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
SCHEMBL19263318 0.95 WNT1 (0.59) WNT1CLK2CLK3DYRK1A
SCHEMBL19263362 0.92 WNT1 (0.71) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL20179056 0.92 WNT1 (0.50) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL20762772 0.90 WNT1 (0.59) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL19263333 0.88 WNT1 (0.63) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL20381325 0.88 WNT1 (0.63) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL19263316 0.88 WNT1 (0.62) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL20762664 0.88 WNT1 (0.59) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL19263348 0.87 WNT1 (0.61) WNT1CLK2CLK3DYRK1ATGFBR1
SCHEMBL17555584 0.86 WNT1 (0.79) WNT1CLK2CLK3DYRK1ATGFBR1

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
US-9738638-B2 2-(1H-indazol-3-yl)-3H-imidazo[4,5-B]pyridine and therapeutic uses thereof SAMUMED, LLC (US) 2017-08-22 US disclosed