SCHEMBL14046570

SCHEMBL14046570

N=C(N)c1ccc(C2CN3CC(c4ccc(/C(N)=N/O)cc4)CCC3=N2)cc1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.39
▸ MAPK1 P28482 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ F2 P00734 1/20 0.31
▸ PRSS1 P07477 1/20 0.31
▸ PRSS2 P07478 1/20 0.31
▸ PRSS3 P35030 1/20 0.31
▸ TMPRSS6 Q8IU80 1/20 0.31
▸ ST14 Q9Y5Y6 1/20 0.31

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
SCHEMBL14028703 0.71 MAPK1 (0.37) MEN1MAPK1KMT2A
SCHEMBL2636397 0.63 MEN1 (0.60) MEN1MAPK1KMT2A
SCHEMBL2636394 0.63 MEN1 (0.60) MEN1MAPK1KMT2A
SCHEMBL2328170 0.61 KMT2A (0.57) MEN1MAPK1KMT2A
SCHEMBL2328166 0.61 KMT2A (0.57) MEN1MAPK1KMT2A
SCHEMBL21215222 0.58 KDM1A (0.60) MEN1MAPK1KMT2A
SCHEMBL12291730 0.56 PRSS1 (0.46) KMT2AF2PRSS1PRSS2PRSS3
SCHEMBL13094278 0.55 F2 (0.59) F2PRSS1PRSS2PRSS3TMPRSS6
SCHEMBL1334368 0.55 KMT2A (0.45) MEN1MAPK1KMT2A
SCHEMBL1334373 0.55 KMT2A (0.45) MEN1MAPK1KMT2A

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-7432278-B2 Dicationic imidazo[1,2-a]pyridines and 5,6,7,8-tetrahydro-imidazo[1,2-a]pyridines as antiprotozoal agents THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2008-10-07 — — US disclosed
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