SCHEMBL30760868

SCHEMBL30760868

CC(C)(C)OC(=O)N1CC[C@@H](n2c(=O)[nH]c3c(N)ncnc32)[C@H](F)C1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 5/20 0.47
▸ EGFR P00533 3/20 0.47
▸ ABL1 P00519 2/20 0.44
▸ ABL2 P42684 2/20 0.44
▸ TGFBR1 P36897 2/20 0.42
▸ PIK3CD O00329 7/20 0.42
▸ GPR119 Q8TDV5 1/20 0.41
▸ RET P07949 1/20 0.38
▸ KDR P35968 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38

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
SCHEMBL30760914 1.00 SRC (0.47) SRCEGFRABL1ABL2TGFBR1
SCHEMBL30760919 1.00 SRC (0.47) SRCEGFRABL1ABL2TGFBR1
SCHEMBL30760832 1.00 SRC (0.47) SRCEGFRABL1ABL2TGFBR1
SCHEMBL15156055 0.89 SRC (0.55) SRCEGFRABL1ABL2TGFBR1
SCHEMBL15145742 0.89 SRC (0.55) SRCEGFRABL1ABL2TGFBR1
SCHEMBL14798023 0.86 SRC (0.48) SRCEGFRABL1ABL2TGFBR1
SCHEMBL31626196 0.86 SRC (0.48) SRCEGFRABL1ABL2TGFBR1
SCHEMBL16321781 0.86 SRC (0.49) SRCEGFRABL1ABL2TGFBR1
SCHEMBL16321782 0.86 SRC (0.49) SRCEGFRABL1ABL2TGFBR1
SCHEMBL28881338 0.85 SRC (0.50) SRCEGFRABL1ABL2TGFBR1

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-2024037527-A1 BTK DEGRADING COMPOUNDS BEIJING NEOX BIOTECH LIMITED (CN) 2024-02-22 — — WO disclosed
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