SCHEMBL31207128

SCHEMBL31207128

Cc1cnc(NC(=O)Cc2ccc(-c3ccoc3)cc2)s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.54
▸ HTT P42858 2/20 0.54
▸ WNT3A P56704 1/20 0.52
▸ ALOX12 P18054 1/20 0.51
▸ MAPK10 P53779 1/20 0.51
▸ CCNE1 P24864 3/20 0.49
▸ CDK2 P24941 3/20 0.49
▸ CDK5 Q00535 3/20 0.49
▸ NPC1 O15118 4/20 0.48
▸ RAB9A P51151 4/20 0.48
▸ KMT2A Q03164 4/20 0.48
▸ LMNA P02545 3/20 0.48
▸ ALDH1A1 P00352 2/20 0.48
▸ MEN1 O00255 2/20 0.48
▸ PKM P14618 2/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ CYP1A2 P05177 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ MAPT P10636 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
SCHEMBL265456 0.81 SMN1; SMN2 (0.68) SMN1; SMN2HTTALOX12MAPK10CCNE1
SCHEMBL31207120 0.81 SMN1; SMN2 (0.58) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31207091 0.81 SMN1; SMN2 (0.53) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31206965 0.80 SMN1; SMN2 (0.57) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31206996 0.79 PORCN (0.60) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31207137 0.78 WNT1 (0.51) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31207089 0.78 WNT3A (0.56) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31207122 0.78 SMN1; SMN2 (0.57) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31207196 0.78 SMN1; SMN2 (0.53) SMN1; SMN2HTTWNT3AALOX12MAPK10
SCHEMBL31206921 0.78 KMT2A (0.55) SMN1; SMN2HTTWNT3AALOX12MAPK10

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-118955493-A Novel CCNK molecular gel degradation agent, preparation method thereof and application thereof as medicine 广东药科大学 2024-11-15 — — CN disclosed
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