SCHEMBL28881308

SCHEMBL28881308

CC(C)(C)OC(=O)N1CCN(c2ccc(Nc3nc(NC4CCCCC4)ccc3C(N)=O)cc2)CC1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 17/20 0.54
▸ ALOX5 P09917 1/20 0.50
▸ GPR119 Q8TDV5 1/20 0.49
▸ CDK4 P11802 1/20 0.48
▸ CCND1 P24385 1/20 0.48
▸ CCND2 P30279 1/20 0.48
▸ CCND3 P30281 1/20 0.48
▸ JAK2 O60674 1/20 0.46
▸ JAK1 P23458 1/20 0.46
▸ JAK3 P52333 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
SCHEMBL28881572 0.86 ALOX5 (0.49) SYKALOX5GPR119CDK4CCND1
SCHEMBL29987427 0.83 SYK (0.64) SYK
SCHEMBL28881306 0.83 SYK (0.64) SYK
SCHEMBL10129237 0.80 RET (0.55) SYKGPR119CCND3JAK3
SCHEMBL29987508 0.79 SYK (0.52) SYKJAK2
SCHEMBL28881298 0.79 SYK (0.52) SYKJAK2
SCHEMBL2693903 0.78 SYK (0.73) SYK
SCHEMBL17690593 0.78 SYK (0.50) SYKGPR119CDK4CCND1CCND2
SCHEMBL5520791 0.77 SYK (0.62) SYKCDK4CCND1CCND2CCND3
SCHEMBL10129238 0.75 EML4 (0.61) SYK

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-115304606-B Degradation agent for simultaneously targeting BTK and GSPT proteins 清华大学 2024-04-19 — — CN disclosed
CN-115304606-A Degradation agent for simultaneously targeting BTK and GSPT1 proteins 清华大学 2022-11-08 — — CN disclosed
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