SCHEMBL30453716

SCHEMBL30453716

Nc1ncc(-c2ccc(C(=O)N3CCC[C@@H]3CN3CCCC3)cc2)nc1OCc1c(Cl)cccc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 3/20 1.00
MET P08581 13/20 0.73
ATR Q13535 1/20 0.60
ALK Q9UM73 2/20 0.53
HRH3 Q9Y5N1 1/20 0.49

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
SCHEMBL487740 1.00 CSF1R (1.00) CSF1RMETATRALKHRH3
SCHEMBL5488534 1.00 CSF1R (1.00) CSF1RMETATRALKHRH3
SCHEMBL30453712 0.88 CSF1R (0.79) CSF1RMETATRALKHRH3
SCHEMBL488002 0.88 CSF1R (0.79) CSF1RMETATRALKHRH3
SCHEMBL30452641 0.86 CSF1R (0.75) CSF1RMETATRALKHRH3
SCHEMBL488141 0.86 CSF1R (0.75) CSF1RMETATRALKHRH3
SCHEMBL488668 0.86 CSF1R (0.75) CSF1RMETATRALKHRH3
SCHEMBL30453070 0.86 CSF1R (0.75) CSF1RMETATRALKHRH3
SCHEMBL488143 0.86 CSF1R (0.75) CSF1RMETATRALKHRH3
SCHEMBL5488939 0.85 CSF1R (0.75) CSF1RMETATRALKHRH3

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