SCHEMBL13623110

SCHEMBL13623110

Nc1ccc(-c2cnc3ccc(N4CCCC4c4cc(F)ccc4F)nn23)cc1N1CCCC1

nearest known ligand 0.61

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 20/20 0.61

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
SCHEMBL12500135 0.94 NTRK1 (0.62) NTRK1
SCHEMBL12503574 0.94 NTRK1 (0.62) NTRK1
SCHEMBL13622998 0.91 NTRK1 (0.64) NTRK1
SCHEMBL12503839 0.91 NTRK1 (0.56) NTRK1
SCHEMBL13622992 0.90 NTRK1 (0.65) NTRK1
SCHEMBL13623106 0.89 NTRK1 (0.57) NTRK1
SCHEMBL13623107 0.89 NTRK1 (0.55) NTRK1
SCHEMBL12502808 0.88 NTRK1 (0.54) NTRK1
SCHEMBL1431155 0.88 NTRK1 (0.59) NTRK1
SCHEMBL13622993 0.88 NTRK1 (0.66) NTRK1

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-2009140128-A2 COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS IRM LLC (BM) 2009-11-19 WO disclosed