SCHEMBL31207127

SCHEMBL31207127

Cc1cnc(NC(=O)Cc2ccc(-c3ccccn3)cc2)s1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ WNT3A P56704 3/20 0.57
▸ CCNE1 P24864 7/20 0.56
▸ CDK2 P24941 7/20 0.56
▸ CDK5 Q00535 7/20 0.56
▸ NPC1 O15118 2/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ PKM P14618 2/20 0.55
▸ SMN1; SMN2 Q16637 5/20 0.54
▸ HTT P42858 3/20 0.54
▸ TP53 P04637 1/20 0.52
▸ ALDH1A1 P00352 2/20 0.51
▸ CCNT1 O60563 1/20 0.51
▸ CDK1 P06493 1/20 0.51
▸ CDK4 P11802 1/20 0.51
▸ CCNB1 P14635 1/20 0.51
▸ CCNA2 P20248 1/20 0.51
▸ CCND1 P24385 1/20 0.51
▸ CDK7 P50613 1/20 0.51
▸ CDK9 P50750 1/20 0.51
▸ CCNH P51946 1/20 0.51

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
SCHEMBL31206965 0.87 SMN1; SMN2 (0.57) WNT3ACCNE1CDK2CDK5NPC1
SCHEMBL31207194 0.86 WNT3A (0.57) WNT3ACCNE1CDK2CDK5NPC1
SCHEMBL31207113 0.86 WNT3A (0.55) WNT3ACCNE1CDK2CDK5NPC1
SCHEMBL31207234 0.86 CCNE1 (0.77) WNT3ACCNE1CDK2CDK5SMN1; SMN2
SCHEMBL31206994 0.85 CCNE1 (0.73) WNT3ACCNE1CDK2CDK5SMN1; SMN2
SCHEMBL31207089 0.85 WNT3A (0.56) WNT3ACCNE1CDK2CDK5NPC1
SCHEMBL31207139 0.85 CCNK (0.56) WNT3ACCNE1CDK2CDK5NPC1
SCHEMBL31206921 0.85 KMT2A (0.55) WNT3ACCNE1CDK2CDK5NPC1
SCHEMBL31206918 0.83 SMN1; SMN2 (0.53) WNT3ACCNE1CDK2CDK5NPC1
SCHEMBL31207080 0.82 RAB9A (0.70) WNT3ACCNE1CDK2CDK5NPC1

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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