SCHEMBL24465178

SCHEMBL24465178

O=C1OC(COCc2ccccc2)[C@@H](OCc2ccccc2)[C@H]1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCHE P06276 2/20 0.48
ACHE P22303 2/20 0.48
TACR2 P21452 3/20 0.45
LMNA P02545 1/20 0.45
NT5E P21589 1/20 0.44
PDPK1 O15530 1/20 0.43
MTOR P42345 1/20 0.43
HTR1A P08908 1/20 0.42
GJB2 P29033 1/20 0.41
PDE4D Q08499 1/20 0.41
SLC6A2 P23975 1/20 0.40
PTPN1 P18031 3/20 0.40
CDC25B P30305 3/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
CTRB1 P17538 1/20 0.40
PTPN2 P17706 1/20 0.40
PTPN6 P29350 1/20 0.40
PTPN11 Q06124 1/20 0.40

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
SCHEMBL18817807 1.00 BCHE (0.48) BCHEACHETACR2LMNANT5E
SCHEMBL18797793 1.00 BCHE (0.48) BCHEACHETACR2LMNANT5E
SCHEMBL18815483 1.00 BCHE (0.48) BCHEACHETACR2LMNANT5E
SCHEMBL22704947 0.87 LMNA (0.44) BCHEACHETACR2LMNANT5E
SCHEMBL30801101 0.86 BCHE (0.54) BCHEACHETACR2LMNANT5E
SCHEMBL22796970 0.86 BCHE (0.54) BCHEACHETACR2LMNANT5E
SCHEMBL12896359 0.86 BCHE (0.54) BCHEACHETACR2LMNANT5E
SCHEMBL18497676 0.86 BCHE (0.54) BCHEACHETACR2LMNANT5E
SCHEMBL3304205 0.86 BCHE (0.54) BCHEACHETACR2LMNANT5E
SCHEMBL14571363 0.86 BCHE (0.54) BCHEACHETACR2LMNANT5E

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
EP-3573718-B1 CYCLIC DINUCLEOTIDES AS STING AGONISTS JANSSEN BIOTECH INC (US) 2022-06-01 EP disclosed