SCHEMBL13622951

SCHEMBL13622951

Nc1cccc(-c2cnc3ccc(N4CCCC4c4cc(F)ccc4F)nn23)c1

nearest known ligand 0.63

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 20/20 0.63
NTRK3 Q16288 3/20 0.58
NTRK2 Q16620 3/20 0.58

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
SCHEMBL13622994 0.90 NTRK1 (0.66) NTRK1
SCHEMBL13622993 0.90 NTRK1 (0.66) NTRK1
SCHEMBL13622992 0.89 NTRK1 (0.65) NTRK1
SCHEMBL13622998 0.88 NTRK1 (0.64) NTRK1
SCHEMBL1431295 0.88 NTRK1 (0.70) NTRK1NTRK3NTRK2
SCHEMBL13622962 0.87 NTRK1 (0.75) NTRK1NTRK3NTRK2
SCHEMBL13623597 0.86 NTRK1 (0.64) NTRK1
SCHEMBL13623110 0.85 NTRK1 (0.61) NTRK1
SCHEMBL13623594 0.85 NTRK1 (0.62) NTRK1NTRK3NTRK2
SCHEMBL13623592 0.85 NTRK1 (0.75) NTRK1NTRK3NTRK2

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