SCHEMBL30453367

SCHEMBL30453367

Nc1ncc(-c2ccccc2F)cc1OCc1c(Cl)cccc1Cl

nearest known ligand 0.65

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MET P08581 7/20 0.65
USP7 Q93009 2/20 0.44
JAK2 O60674 2/20 0.44
MAP4K3 Q8IVH8 2/20 0.44
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
KDM4E B2RXH2 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MAP4K4 O95819 2/20 0.40
MPO P05164 1/20 0.40
CSF1R P07333 1/20 0.39
PTGER1 P34995 1/20 0.39
PTGER4 P35408 1/20 0.39
PTGER3 P43115 1/20 0.39
PTGER2 P43116 1/20 0.39

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
SCHEMBL487729 1.00 MET (0.65) METUSP7JAK2MAP4K3MEN1
SCHEMBL6361398 0.86 MET (0.69) METUSP7JAK2MAP4K3SMN1; SMN2
SCHEMBL488145 0.85 MET (0.68) METJAK2MAP4K3MEN1KMT2A
SCHEMBL487522 0.85 MET (0.72) METUSP7JAK2MAP4K3MEN1
SCHEMBL30452575 0.85 MET (0.72) METUSP7JAK2MAP4K3MEN1
SCHEMBL487923 0.85 MET (0.61) METUSP7JAK2MAP4K3MAP4K4
SCHEMBL30452662 0.85 MET (0.61) METUSP7JAK2MAP4K3MAP4K4
SCHEMBL488125 0.84 MET (0.63) METUSP7MAP4K3SMN1; SMN2MAP4K4
SCHEMBL30453937 0.84 MET (0.63) METUSP7MAP4K3SMN1; SMN2MAP4K4
SCHEMBL27650091 0.84 MET (0.82) METUSP7MAP4K4PTGER1PTGER4

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