SCHEMBL27839550

SCHEMBL27839550

CC(C)(C)OC(=O)Nc1ccccc1OB(O)O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.44
▸ POLB P06746 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.43
▸ BRD9 Q9H8M2 1/20 0.42
▸ KMT2A Q03164 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ METAP1 P53582 1/20 0.41
▸ PDK1 Q15118 1/20 0.40
▸ PDK2 Q15119 1/20 0.40
▸ PDK3 Q15120 1/20 0.40
▸ PDK4 Q16654 1/20 0.40
▸ TDP2 O95551 1/20 0.40
▸ PRMT5 O14744 1/20 0.40
▸ WDR77 Q9BQA1 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ ALOX12 P18054 1/20 0.40
▸ GAA P10253 1/20 0.38
▸ BRD4 O60885 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
SCHEMBL1320504 0.86 RXFP1 (0.40) LMNAPOLBRXFP1BRD9KMT2A
SCHEMBL30793049 0.86 RXFP1 (0.43) LMNAPOLBRXFP1BRD9KMT2A
SCHEMBL22735089 0.83 LMNA (0.47) LMNAPOLBRXFP1BRD9KMT2A
SCHEMBL29991357 0.83 KMT2A (0.59) LMNAPOLBKMT2AL3MBTL1PDK1
SCHEMBL729221 0.83 KMT2A (0.59) LMNAPOLBKMT2AL3MBTL1PDK1
SCHEMBL2061241 0.82 LMNA (0.50) LMNAPOLBRXFP1BRD9KMT2A
SCHEMBL2880191 0.82 LMNA (0.54) LMNAPOLBRXFP1BRD9KMT2A
SCHEMBL7721814 0.81 LMNA (0.55) LMNAPOLBKMT2AL3MBTL1PDK1
SCHEMBL15060256 0.81 LMNA (0.46) LMNAPOLBRXFP1BRD9KMT2A
SCHEMBL31604225 0.80 GAA (0.39) RXFP1BRD9GAA

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-102762226-A Benzonaphthyridine-containing vaccines NOVARTIS AG 2012-10-31 — — CN disclosed
CN-102015651-A Compounds and compositions as TLR activity modulators IRM LLC 2011-04-13 — — CN disclosed
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