SCHEMBL2365033

SCHEMBL2365033

[P]Nc1ccnn2cncc12

nearest known ligand 0.37

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
EPHB3 P54753 6/20 0.37
IDO1 P14902 1/20 0.35
TDO2 P48775 1/20 0.35
LCK P06239 5/20 0.33
RIPK2 O43353 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
TGFBR1 P36897 1/20 0.32
TGFBR2 P37173 1/20 0.32

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
SCHEMBL2361837 0.73
SCHEMBL20299311 0.71 SMPD3 (0.37) IDO1LCK
SCHEMBL4840455 0.67 IDO1 (0.32) IDO1
SCHEMBL4569210 0.67 HSP90AA1 (0.36)
SCHEMBL20029255 0.64 CCNK (0.38) IDO1
SCHEMBL21672742 0.63 IDO1 (0.31) IDO1TDO2
SCHEMBL30544213 0.61 CYP19A1 (0.32) IDO1TDO2
SCHEMBL6349183 0.60 IDO1 (0.53) IDO1TDO2
SCHEMBL30544222 0.60 IDO1 (0.31) IDO1
SCHEMBL3396471 0.59

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-2361919-A1 Imidazo[1,5-b] pyridazin-amino-phosphorous ligands and their complex compounds AIKAA-Chemicals GmbH (DE) 2011-08-31 EP disclosed