SCHEMBL30453324

SCHEMBL30453324

CC(Oc1nc(-c2cccc(C(=O)N3CCC[C@H]3CN3CCCC3)c2)cnc1N)c1c(Cl)cccc1Cl

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MET P08581 15/20 0.69
CSF1R P07333 2/20 0.65
CHEK2 O96017 1/20 0.50
ATR Q13535 1/20 0.49
ALK Q9UM73 2/20 0.43

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
SCHEMBL30453371 1.00 MET (0.69) METCSF1RCHEK2ATRALK
SCHEMBL488310 1.00 MET (0.69) METCSF1RCHEK2ATRALK
SCHEMBL488568 1.00 MET (0.69) METCSF1RCHEK2ATRALK
SCHEMBL488313 1.00 MET (0.69) METCSF1RCHEK2ATRALK
SCHEMBL488141 0.93 CSF1R (0.75) METCSF1RCHEK2ATRALK
SCHEMBL488143 0.93 CSF1R (0.75) METCSF1RCHEK2ATRALK
SCHEMBL30452641 0.93 CSF1R (0.75) METCSF1RCHEK2ATRALK
SCHEMBL488668 0.93 CSF1R (0.75) METCSF1RCHEK2ATRALK
SCHEMBL30453070 0.93 CSF1R (0.75) METCSF1RCHEK2ATRALK
SCHEMBL488240 0.92 MET (0.69) METCSF1RCHEK2ATR

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
CN-113181362-B Medicament for preventing and/or treating amyotrophic lateral sclerosis 国立大学法人京都大学 2023-06-13 CN disclosed