SCHEMBL29132281

SCHEMBL29132281

O=C1CCC(N2Cc3c(NCCCCN4CCC(CN5CCNCC5)CC4)cccc3C2=O)C(=O)N1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAP1LC3B Q9GZQ8 7/20 0.52
▸ CRBN Q96SW2 7/20 0.48
▸ IKZF1 Q13422 2/20 0.48
▸ IKZF2 Q9UKS7 1/20 0.48
▸ TNF P01375 4/20 0.48
▸ IKZF3 Q9UKT9 3/20 0.48
▸ DDB1 Q16531 2/20 0.48
▸ BRD4 O60885 1/20 0.48
▸ IL1B P01584 1/20 0.48
▸ STAT3 P40763 1/20 0.46
▸ JAK2 O60674 1/20 0.44
▸ AXL P30530 1/20 0.44

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
SCHEMBL25238550 0.94 MAP1LC3B (0.56) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL30042173 0.94 MAP1LC3B (0.56) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL26814281 0.86 CRBN (0.54) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL24830078 0.86 TNF (0.56) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL25905191 0.85 MAP1LC3B (0.66) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL29132183 0.85 STAT3 (0.57) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL29928281 0.85 STAT3 (0.57) MAP1LC3BCRBNIKZF1TNFIKZF3
Hydrochloric Acid SCHEMBL25327075 0.85 MAP1LC3B (0.65) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL22959759 0.84 MAP1LC3B (0.53) MAP1LC3BCRBNIKZF1TNFIKZF3
SCHEMBL29132232 0.84 MAP1LC3B (0.50) MAP1LC3BCRBNTNFIKZF3STAT3

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
EP-4308557-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE Arvinas Operations, Inc. (US) 2024-01-24 — — EP disclosed
CN-117321046-A Indazole-based compounds and related methods of use 阿维纳斯企业公司 2023-12-29 — — CN disclosed
WO-2022198112-A1 INDAZOLE BASED COMPOUNDS AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. (US) 2022-09-22 — — WO disclosed
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