SCHEMBL2558067

SCHEMBL2558067

CC(C)(C)OC(=O)N1CC(c2ccc(B(O)O)cc2)C1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.45
KDM4E B2RXH2 1/20 0.44
PDE4B Q07343 7/20 0.44
NAMPT P43490 2/20 0.43
NR1H2 P55055 1/20 0.41
GPR119 Q8TDV5 3/20 0.41

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
SCHEMBL15330866 0.89 PDE4B (0.56) KDM4EPDE4BNAMPTGPR119
SCHEMBL15332363 0.88 PDE4B (0.50) PDE4BNAMPTGPR119
SCHEMBL12419663 0.86 NAMPT (0.58) KDM4EPDE4BNAMPTGPR119
SCHEMBL15330319 0.84 RORC (0.45) RORCKDM4EPDE4BNAMPTNR1H2
SCHEMBL23091747 0.84 NAMPT (0.51) RORCKDM4EPDE4BNAMPTNR1H2
SCHEMBL17736163 0.84 GPR119 (0.53) RORCKDM4EPDE4BNAMPTNR1H2
SCHEMBL20607546 0.84 RORC (0.48) RORCKDM4EPDE4BNAMPTNR1H2
SCHEMBL21747998 0.83 NAMPT (0.55) KDM4EPDE4BNAMPTGPR119
SCHEMBL20757468 0.82 MEN1 (0.57) RORCKDM4EPDE4BNAMPT
SCHEMBL21381667 0.82 RORC (0.53) RORCKDM4EPDE4BNAMPTNR1H2

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024062250-A1 IMIDAZOLYL-AMINO-PYRAZINE-CARBONITRILS AS CHK-1 INHIBITORS BENEVOLENTAI BIO LIMITED (GB) 2024-03-28 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
US-11225655-B2 Bi-functional complexes and methods for making and using such complexes NUEVOLUTION A/S (DK) 2022-01-18 US disclosed
EP-3540059-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2019-09-18 EP disclosed
EP-2558577-B1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION AS (DK) 2018-12-12 EP disclosed
US-20130281324-A1 BI-FUNCTINAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2013-10-24 US disclosed
EP-2558577-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES Nuevolution A/S (DK) 2013-02-20 EP disclosed
WO-2011127933-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2011-10-20 WO disclosed