SCHEMBL30733147

SCHEMBL30733147

CC(C)(C)OC(=O)N1CCC2CC(O)CC2C1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H2 P55055 1/20 0.55
JAK2 O60674 1/20 0.55
JAK1 P23458 1/20 0.55
CHRM2 P08172 1/20 0.51
CHRM1 P11229 1/20 0.51
CHRM3 P20309 1/20 0.51
GPR119 Q8TDV5 10/20 0.48
HPGD P15428 1/20 0.47
RECQL P46063 1/20 0.44
EPHX1 P07099 1/20 0.44
PTPN2 P17706 1/20 0.44
PTPN1 P18031 1/20 0.44
PTPN6 P29350 1/20 0.44

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
SCHEMBL19389997 0.92 NR1H2 (0.59) NR1H2JAK2JAK1GPR119HPGD
SCHEMBL39998 0.91 JAK2 (0.50) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL29913770 0.91 JAK2 (0.50) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL27427012 0.91 NR1H2 (0.52) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL43022 0.91 JAK2 (0.50) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL24740662 0.89 NR1H2 (0.68) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL20936763 0.89 NR1H2 (0.68) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL20566533 0.89 NR1H2 (0.68) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL20936755 0.89 NR1H2 (0.68) NR1H2JAK2JAK1CHRM2CHRM1
SCHEMBL4409452 0.89 NR1H2 (0.68) NR1H2JAK2JAK1CHRM2CHRM1

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
CN-117377675-A Bruton's tyrosine kinase degradation agent containing parallel ring or spiro ring 正大天晴药业集团股份有限公司 2024-01-09 CN disclosed