SCHEMBL19645539

SCHEMBL19645539

CCCCC(O)Nc1cncc(-c2ccc3[nH]nc(-c4nc5c(-c6ccc(C(C)=O)s6)nccc5[nH]4)c3c2F)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
WNT1 P04628 9/20 0.48
TGFBR1 P36897 6/20 0.48
CLK2 P49760 11/20 0.47
CLK3 P49761 11/20 0.47
DYRK1A Q13627 11/20 0.47

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
SCHEMBL20747753 0.90 WNT1 (0.47) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL17588406 0.90 CLK2 (0.52) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL19356403 0.89 WNT1 (0.51) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL17588412 0.89 CLK2 (0.53) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL20439295 0.89 CLK2 (0.52) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL20976074 0.87 WNT1 (0.47) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL17588411 0.87 CLK2 (0.58) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL17588389 0.87 WNT1 (0.55) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL19860564 0.86 WNT1 (0.50) WNT1TGFBR1CLK2CLK3DYRK1A
SCHEMBL20747746 0.86 WNT1 (0.51) WNT1TGFBR1CLK2CLK3DYRK1A

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-9828372-B2 2-(1H-indazol-3-yl)-1H-imidazo[4,5-C]pyridine and therapeutic uses thereof SAMUMED, LLC (US) 2017-11-28 US disclosed