SCHEMBL29593210

SCHEMBL29593210

CC(C)(C)OC(=O)Nc1nc(F)nc2[nH]cnc12

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 2/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ ATR Q13535 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ LCK P06239 3/20 0.34
▸ MAPT P10636 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ PSMB8 P28062 1/20 0.33
▸ METAP1 P53582 1/20 0.33

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
SCHEMBL22939319 1.00 SYK (0.39) SYKL3MBTL1ATRCA1CA2
SCHEMBL19738337 0.86 SYK (0.39) SYKL3MBTL1ATRLCKMAPT
SCHEMBL19738205 0.86 SYK (0.39) SYKL3MBTL1ATRMAPTTDP1
SCHEMBL19738338 0.86 SYK (0.37) SYKL3MBTL1ATRMAPTTDP1
SCHEMBL19738339 0.85 SYK (0.39) SYKL3MBTL1ATRCA1CA2
SCHEMBL29124868 0.84 SYK (0.38) SYKL3MBTL1ATRMAPTTDP1
SCHEMBL29124870 0.83 SYK (0.37) SYKL3MBTL1ATRMAPTTDP1
SCHEMBL24653331 0.81 AURKA (0.40) SYKL3MBTL1ATRCA1CA2
SCHEMBL29124862 0.80 SYK (0.36) SYKL3MBTL1MAPTTDP1
SCHEMBL16146754 0.80 GDA (0.39) L3MBTL1

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
EP-4003369-A1 ADENOSINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING THE SAME Brii Biosciences, Inc. (US) 2022-06-01 — — EP disclosed
CN-114502175-A Adenosine derivatives and pharmaceutical compositions containing the same 腾盛博药生物科技有限公司 2022-05-13 — — CN disclosed
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