SCHEMBL13956849

SCHEMBL13956849

CCO/N=C/c1c(N2CCN(C(=O)Cc3ccc(C(C)C)cc3)CC2)ncpc1N

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PANK3 Q9H999 8/20 0.49
▸ FLT3 P36888 8/20 0.46
▸ AKT1 P31749 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36

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
SCHEMBL3882199 0.86 FLT3 (0.61) PANK3FLT3
SCHEMBL14596996 0.86 FLT3 (0.61) PANK3FLT3
SCHEMBL13956287 0.86 FLT3 (0.61) PANK3FLT3
SCHEMBL13751779 0.77 FLT3 (0.73) PANK3FLT3
SCHEMBL3888652 0.77 FLT3 (0.73) PANK3FLT3
SCHEMBL26502429 0.70 PANK3 (0.59) PANK3AKT1
SCHEMBL21406473 0.69 PANK3 (0.67) PANK3AKT1MEN1KMT2A
SCHEMBL26501618 0.68 PANK3 (0.76) PANK3POLBMEN1KMT2A
SCHEMBL21423846 0.67 PANK3 (0.72) PANK3
SCHEMBL21423676 0.67 PANK3 (1.00) PANK3POLB

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
EP-1898917-B1 AMINOPYRIMIDINES AS KINASE MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2009-01-14 — — EP disclosed
Send feedback