SCHEMBL28824947

SCHEMBL28824947

NC(=O)c1cccnc1Nc1ccc(Cl)c(F)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.67
▸ RAB9A P51151 7/20 0.60
▸ SMN1; SMN2 Q16637 6/20 0.60
▸ MAPT P10636 5/20 0.60
▸ NPC1 O15118 5/20 0.60
▸ AHR P35869 1/20 0.60
▸ HTT P42858 1/20 0.59
▸ MEN1 O00255 6/20 0.55
▸ KMT2A Q03164 6/20 0.55
▸ ALDH1A1 P00352 5/20 0.55
▸ KCNH2 Q12809 1/20 0.55
▸ HPGD P15428 2/20 0.53
▸ AURKA O14965 1/20 0.53
▸ RPS6KB1 P23443 1/20 0.53
▸ DHODH Q02127 4/20 0.51
▸ NPSR1 Q6W5P4 1/20 0.50
▸ MET P08581 1/20 0.48
▸ JAK2 O60674 1/20 0.48
▸ JAK1 P23458 1/20 0.48
▸ GRM4 Q14833 1/20 0.46

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
SCHEMBL29898281 1.00 LMNA (0.67) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL2712558 0.90 LMNA (0.67) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL9494044 0.88 RAB9A (0.64) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL28824933 0.81 RAB9A (0.76) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL29898323 0.81 RAB9A (0.76) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL5255345 0.80 LMNA (0.71) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL9496511 0.80 LMNA (1.00) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL15965812 0.80 CA12 (0.50) LMNANPC1HTTMEN1KMT2A
SCHEMBL28824926 0.78 MAPT (0.71) LMNARAB9ASMN1; SMN2MAPTNPC1
SCHEMBL29898293 0.78 MAPT (0.71) LMNARAB9ASMN1; SMN2MAPTNPC1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116574053-A RIPK1 kinase target inhibitor and medical application thereof 中国药科大学 2023-08-11 — — CN disclosed
CN-114989079-B RIPK1 kinase target inhibitor and medical application thereof 中国药科大学 2023-06-23 — — CN disclosed
CN-114989079-A RIPK1 kinase target inhibitor and medical application thereof 中国药科大学 2022-09-02 — — CN disclosed
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