SCHEMBL29964196

SCHEMBL29964196

CC1(C)NC(=O)c2ccc(B3OC(C)(C)C(C)(C)O3)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 1/20 0.40
▸ MKNK2 Q9HBH9 1/20 0.40
▸ LPL P06858 9/20 0.39
▸ LIPG Q9Y5X9 9/20 0.39
▸ BACE1 P56817 5/20 0.39
▸ PRMT5 O14744 1/20 0.37
▸ WDR77 Q9BQA1 1/20 0.37
▸ CA1 P00915 2/20 0.37
▸ CA2 P00918 2/20 0.37
▸ CA9 Q16790 2/20 0.37
▸ CA12 O43570 1/20 0.37
▸ CA3 P07451 1/20 0.37
▸ CA4 P22748 1/20 0.37
▸ CA6 P23280 1/20 0.37
▸ CA5A P35218 1/20 0.37
▸ CA7 P43166 1/20 0.37
▸ CA14 Q9ULX7 1/20 0.37
▸ CA5B Q9Y2D0 1/20 0.37
▸ CSF1R P07333 1/20 0.35
▸ IDO1 P14902 1/20 0.34

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
SCHEMBL24681504 1.00 MKNK1 (0.40) MKNK1MKNK2LPLLIPGBACE1
SCHEMBL19049762 0.88 LPL (0.39) LPLLIPGBACE1PRMT5WDR77
SCHEMBL12077723 0.85 BACE1 (0.42) LPLLIPGBACE1PRMT5WDR77
SCHEMBL30926403 0.83 BACE1 (0.41) LPLLIPGBACE1PRMT5WDR77
SCHEMBL30926385 0.78 CDC7 (0.39) LPLLIPGBACE1PRMT5WDR77
SCHEMBL12078315 0.78 CDC7 (0.39) LPLLIPGBACE1PRMT5WDR77
SCHEMBL3450261 0.78 LPL (0.43) LPLLIPGPRMT5WDR77CA1
SCHEMBL29909145 0.78 LPL (0.43) LPLLIPGPRMT5WDR77CA1
SCHEMBL16006501 0.77 BACE1 (0.40) LPLLIPGBACE1PRMT5WDR77
SCHEMBL30416516 0.77 BACE1 (0.40) LPLLIPGBACE1PRMT5WDR77

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
WO-2022226666-A1 SUBSTITUTED AMINO AZA-HETEROARYL COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — WO disclosed
WO-2022226668-A1 HALO-SUBSTITUTED AMINO PYRIDINE COMPOUNDS AS INHIBITORS OF THE HAEMATOPOIETIC PROGENITOR KINASE 1 (HPK1) ONTARIO INSTITUTE FOR CANCER RESEARCH (OICR) (CA) 2022-11-03 — — WO disclosed
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