SCHEMBL28654673

SCHEMBL28654673

O=C1CCC(=O)N1c1cccc2cc[nH]c12

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 2/20 0.43
▸ KEAP1 Q14145 1/20 0.42
▸ PDPK1 O15530 1/20 0.41
▸ BRD4 O60885 2/20 0.39
▸ TAF1 P21675 1/20 0.39
▸ BRPF1 P55201 1/20 0.39
▸ CREBBP Q92793 1/20 0.39
▸ CECR2 Q9BXF3 1/20 0.39
▸ BRD9 Q9H8M2 1/20 0.39
▸ NR3C1 P04150 1/20 0.38
▸ PGR P06401 1/20 0.38
▸ NR3C2 P08235 1/20 0.38
▸ AR P10275 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ BCHE P06276 3/20 0.37
▸ BACE1 P56817 1/20 0.36
▸ TRPA1 O75762 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ ITGB2 P05107 1/20 0.35

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
SCHEMBL28840823 0.81 TLR9 (0.50) AHRKEAP1PDPK1BRD4TAF1
SCHEMBL21805200 0.76 HTR6 (0.39) AHRKEAP1PDPK1BRD4TAF1
SCHEMBL30088186 0.76 HTR6 (0.39) AHRKEAP1PDPK1BRD4TAF1
SCHEMBL28841040 0.72 ADRB1 (0.53) AHRRECQL
SCHEMBL21919929 0.72 GSK3A (0.42) AHRKEAP1PDPK1BRD4TAF1
SCHEMBL7229298 0.71 AHR (0.42) AHRKEAP1PDPK1BRD4TAF1
SCHEMBL21805792 0.71 BRD4 (0.39) AHRKEAP1PDPK1BRD4TAF1
SCHEMBL21921417 0.71 BCHE (0.45) AHRKEAP1PDPK1CREBBPBCHE
SCHEMBL30087795 0.71 BRD4 (0.39) AHRKEAP1PDPK1BRD4TAF1
SCHEMBL14861202 0.71 AHR (0.36) AHRKEAP1PDPK1BRD4TAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113735832-B Preparation method of 7-succinimidyl indole compound 温州医科大学 2023-07-04 — — CN claimed
CN-113735832-A Preparation method of 7-succinimide indole compound 温州医科大学 2021-12-03 — — CN claimed
CN-113735832-B Preparation method of 7-succinimidyl indole compound 温州医科大学 2023-07-04 — — CN disclosed
CN-113735832-B Preparation method of 7-succinimidyl indole compound 温州医科大学 2023-07-04 — — CN disclosed
CN-113735832-B Preparation method of 7-succinimidyl indole compound 温州医科大学 2023-07-04 — — CN disclosed
CN-113735832-A Preparation method of 7-succinimide indole compound 温州医科大学 2021-12-03 — — CN disclosed
CN-113735832-A Preparation method of 7-succinimide indole compound 温州医科大学 2021-12-03 — — CN disclosed
CN-113735832-A Preparation method of 7-succinimide indole compound 温州医科大学 2021-12-03 — — CN disclosed
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