SCHEMBL6668573

SCHEMBL6668573

NCCCNc1nc(C=Cc2ccc(-c3ccccc3)cc2)nc2ccc(I)cc12

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 6/20 0.48

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
SCHEMBL3537305 0.92 FLT3 (0.44) FLT3
SCHEMBL3537301 0.92 FLT3 (0.44) FLT3
SCHEMBL3543651 0.90 FLT3 (0.54) FLT3
SCHEMBL3543654 0.90 FLT3 (0.54) FLT3
SCHEMBL3545094 0.88 FLT3 (0.44) FLT3
SCHEMBL3545092 0.88 FLT3 (0.44) FLT3
SCHEMBL3532070 0.82 PDE5A (0.40) FLT3
SCHEMBL3532072 0.82 PDE5A (0.40) FLT3
SCHEMBL3541533 0.78 TRIM58 (0.43)
SCHEMBL3541535 0.78 TRIM58 (0.43)

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-2004030671-A2 USE OF 4-AMINO-QUINAZOLINES AS ANTI CANCER AGENTS MERCK PATENT GMBH (DE) 2004-04-15 WO disclosed