SCHEMBL21946753

SCHEMBL21946753

CC(C)(C)OC(=O)N1CCN(c2ccc(Nc3nc(N4CCCCC4)cnc3C(N)=O)nc2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 2/20 0.48
▸ SKP1 P63208 2/20 0.48
▸ SKP2 Q13309 2/20 0.48
▸ LCK P06239 9/20 0.48
▸ BTK Q06187 6/20 0.48
▸ JAK3 P52333 11/20 0.47
▸ EGFR P00533 3/20 0.47
▸ SYK P43405 1/20 0.45
▸ WNT3A P56704 1/20 0.44
▸ TBK1 Q9UHD2 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ GPR119 Q8TDV5 1/20 0.42
▸ CCNK O75909 1/20 0.41
▸ CCNA2 P20248 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CCND3 P30281 1/20 0.41

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
SCHEMBL21855164 0.90 LCK (0.59) CKS1BSKP1SKP2LCKBTK
SCHEMBL21946318 0.90 LCK (0.59) CKS1BSKP1SKP2LCKBTK
SCHEMBL31039906 0.90 LCK (0.59) CKS1BSKP1SKP2LCKBTK
SCHEMBL24927490 0.90 LCK (0.59) CKS1BSKP1SKP2LCKBTK
SCHEMBL21946309 0.85 JAK3 (0.51) CKS1BSKP1SKP2LCKBTK
SCHEMBL23081098 0.85 LCK (0.59) LCKBTKJAK3EGFRCCNA2
SCHEMBL21855238 0.84 JAK3 (0.62) LCKBTKJAK3EGFR
SCHEMBL21946911 0.84 LCK (0.54) CKS1BSKP1SKP2LCKBTK
SCHEMBL21946907 0.83 LCK (0.54) LCKBTKJAK3EGFR
SCHEMBL21946745 0.82 CDK4 (0.49) LCKBTKJAK3EGFRSYK

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
WO-2020081450-A1 BIFUNCTIONAL COMPOUNDS FOR DEGRADING BTK VIA UBIQUITIN PROTEOSOME PATHWAY NURIX THERAPEUTICS, INC. (US) 2020-04-23 — — WO disclosed
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