SCHEMBL22915758

SCHEMBL22915758

CC(=O)O[C@H]1[C@H](n2cnc3c(NC(=O)c4ccccc4)ncnc32)O[C@H](COC(=O)c2ccccc2)[C@@]1(C)C(C)(F)F

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.47
▸ LMNA P02545 1/20 0.42
▸ PRKAB2 O43741 1/20 0.41
▸ PRKAG1 P54619 1/20 0.41
▸ PRKAA2 P54646 1/20 0.41
▸ PRKAA1 Q13131 1/20 0.41
▸ PRKAG3 Q9UGI9 1/20 0.41
▸ PRKAG2 Q9UGJ0 1/20 0.41
▸ PRKAB1 Q9Y478 1/20 0.41
▸ P2RY12 Q9H244 4/20 0.41
▸ ADORA1 P30542 1/20 0.39
▸ P2RY2 P41231 1/20 0.39
▸ P2RY1 P47900 1/20 0.39
▸ P2RY6 Q15077 1/20 0.39
▸ BMPR1B O00238 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
SCHEMBL24649458 0.87 PRMT6 (0.47) PRMT6LMNAPRKAB2PRKAG1PRKAA2
SCHEMBL15445650 0.84 PRMT6 (0.44) PRMT6LMNAP2RY12ADORA1P2RY2
SCHEMBL7158740 0.80 PRMT6 (0.41) PRMT6LMNAP2RY12ADORA1P2RY2
SCHEMBL5982554 0.79 PRMT6 (0.62) PRMT6LMNAPRKAB2PRKAG1PRKAA2
SCHEMBL14388686 0.78 P2RY12 (0.51) LMNAP2RY12
SCHEMBL31725289 0.77 PRMT6 (0.54) PRMT6LMNAPRKAB2PRKAG1PRKAA2
SCHEMBL13151614 0.77 LMNA (0.45) PRMT6LMNAP2RY12P2RY2P2RY1
SCHEMBL22983997 0.76 P2RX3 (0.59) PRMT6LMNAPRKAB2PRKAG1PRKAA2
SCHEMBL14853789 0.76 PRMT6 (0.46) PRMT6PRKAB2PRKAG1PRKAA2PRKAA1
SCHEMBL13902897 0.76 P2RY12 (0.64) LMNAP2RY12P2RY2P2RY1P2RY6

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
WO-2021013234-A1 CYCLIC DINUCLEOTIDES AS STING AGONISTS BEIGENE, LTD. (KY) 2021-01-28 — — WO disclosed
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