SCHEMBL28064432

SCHEMBL28064432

CC(C)(C)NC(=O)O[C@H]1CCCC[C@H]1N

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ MEN1 O00255 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ ATM Q13315 1/20 0.32
▸ SMN1; SMN2 Q16637 2/20 0.32
▸ EPHX1 P07099 4/20 0.32
▸ DPP4 P27487 2/20 0.32
▸ MMP2 P08253 2/20 0.31
▸ MMP9 P14780 2/20 0.31
▸ CA12 O43570 2/20 0.31
▸ CA1 P00915 2/20 0.31
▸ CA2 P00918 2/20 0.31
▸ CA9 Q16790 2/20 0.31
▸ MMP1 P03956 1/20 0.31
▸ MMP3 P08254 1/20 0.31
▸ MMP8 P22894 1/20 0.31
▸ MMP13 P45452 1/20 0.31
▸ BTK Q06187 1/20 0.30

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
SCHEMBL27621632 1.00 LMNA (0.33) LMNAL3MBTL1MEN1MAPTKMT2A
SCHEMBL18398614 1.00 LMNA (0.33) LMNAL3MBTL1MEN1MAPTKMT2A
SCHEMBL1766146 0.97 BTK (0.33) LMNAL3MBTL1SMN1; SMN2DPP4BTK
SCHEMBL28590963 0.97 BTK (0.33) LMNAL3MBTL1SMN1; SMN2DPP4BTK
SCHEMBL16096263 0.97 BTK (0.33) LMNAL3MBTL1SMN1; SMN2DPP4BTK
SCHEMBL1766144 0.97 BTK (0.33) LMNAL3MBTL1SMN1; SMN2DPP4BTK
SCHEMBL28861016 0.85 GBA1 (0.33) LMNADPP4BTK
SCHEMBL27895229 0.81 GSR (0.42) LMNAL3MBTL1MEN1MAPTKMT2A
SCHEMBL27919816 0.81 CYP19A1 (0.40) LMNAL3MBTL1MEN1MAPTKMT2A
SCHEMBL16995324 0.77 CHRM2 (0.42) MEN1KMT2AMMP2MMP9CA12

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-113121562-A Polycyclic compounds as inhibitors of bruton's tyrosine kinase 詹森药业有限公司 2021-07-16 — — CN disclosed
CN-105658642-A Fibroblast growth factor receptor inhibitors 蓝图药品公司 2016-06-08 — — CN disclosed
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