SCHEMBL19908229

SCHEMBL19908229

O=C(c1ccc(-c2cnc3c(c2)N(c2c(Cl)cccc2Cl)CCN3)cc1)N1CCCC1CN1CCCC1

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALK Q9UM73 6/20 0.78
MET P08581 12/20 0.61
CSF1R P07333 2/20 0.52

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
SCHEMBL12052420 0.88 ALK (1.00) ALKMETCSF1R
SCHEMBL1600989 0.88 ALK (1.00) ALKMETCSF1R
SCHEMBL12730694 0.84 ALK (1.00) ALKMET
SCHEMBL1601411 0.84 ALK (1.00) ALKMET
SCHEMBL1601008 0.82 ALK (0.78) ALKMET
SCHEMBL1602249 0.82 ALK (1.00) ALKMETCSF1R
SCHEMBL19908271 0.82 ALK (0.78) ALKMET
SCHEMBL19908488 0.82 ALK (1.00) ALKMETCSF1R
SCHEMBL1601551 0.80 ALK (0.75) ALKMET
SCHEMBL1601548 0.80 ALK (0.75) ALKMET

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-2091951-B1 PYRIDO[2,3-B]PYRAZINE AND [1,8]-NAPHTHYRIDINE DERIVATIVES AS ALK AND C-MET INHIBITORS CEPHALON INC (US) 2018-02-28 EP disclosed