SCHEMBL24508322

SCHEMBL24508322

CC(C)(C)OC(=O)N1CCC(OCC#Cc2cccc3c(N4CCC(=O)NC4=O)cncc23)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DDB1 Q16531 10/20 0.48
CRBN Q96SW2 10/20 0.48
GPR119 Q8TDV5 6/20 0.39
KDM1A O60341 1/20 0.37
CYP11B2 P19099 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
PRKCG P05129 1/20 0.35
PRKCB P05771 1/20 0.35
PRKCA P17252 1/20 0.35
PRKCH P24723 1/20 0.35
PRKCE Q02156 1/20 0.35
PRKCD Q05655 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
SCHEMBL30545173 0.87 DDB1 (0.46) DDB1CRBNKDM1ACYP11B2
SCHEMBL23832682 0.86 DDB1 (0.46) DDB1CRBNGPR119CYP11B2PRKCG
SCHEMBL24509260 0.85 DDB1 (0.43) DDB1CRBNGPR119CYP11B2
SCHEMBL24508323 0.84 CRBN (0.39) DDB1CRBN
SCHEMBL30545126 0.84 CRBN (0.39) DDB1CRBN
SCHEMBL29709883 0.81 DDB1 (0.47) DDB1CRBNGPR119CYP11B2
SCHEMBL24508841 0.81 DDB1 (0.47) DDB1CRBNGPR119CYP11B2
SCHEMBL24508642 0.81 DDB1 (0.42) DDB1CRBNGPR119KDM1APRMT5
SCHEMBL24608024 0.80 DDB1 (0.41) DDB1CRBNGPR119KDM1ACYP11B2
SCHEMBL31565145 0.80 DDB1 (0.41) DDB1CRBNGPR119KDM1ACYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116669722-A Interleukin-1 receptor-related kinase (IRAK) degradants and uses thereof 凯麦拉医疗公司 2023-08-29 CN disclosed
WO-2022125790-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. (US) 2022-06-16 WO disclosed