SCHEMBL29674494

SCHEMBL29674494

Cc1ccc(OC(=S)O[C@@H]2[C@H]3O[Si](C(C)C)(C(C)C)O[Si](C(C)C)(C(C)C)OC[C@@H]3O[C@H]2n2cnc3c(NC(=O)c4ccccc4)ncnc32)cc1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ PRMT6 Q96LA8 1/20 0.40
▸ PDE4A P27815 2/20 0.39
▸ PDE4D Q08499 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ HTR1A P08908 1/20 0.39
▸ CYP2D6 P10635 1/20 0.39
▸ ADRB3 P13945 1/20 0.39
▸ PTGS2 P35354 1/20 0.39
▸ PDE3A Q14432 1/20 0.39
▸ LMNA P02545 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ P2RY12 Q9H244 4/20 0.35
▸ PDE4B Q07343 1/20 0.34
▸ PDE4C Q08493 1/20 0.34

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
SCHEMBL22984002 1.00 PRMT6 (0.40) PRMT6PDE4APDE4DCYP1A2HTR1A
SCHEMBL25966452 0.88 PRMT6 (0.42) PRMT6PDE4APDE4DCYP1A2HTR1A
SCHEMBL10457978 0.86 PRMT6 (0.42) PRMT6PDE4APDE4DCYP1A2HTR1A
SCHEMBL10457977 0.85 PRMT6 (0.40) PRMT6PDE4APDE4DCYP1A2HTR1A
SCHEMBL9945534 0.83 PDE4A (0.47) PDE4APDE4DP2RY12PDE4BPDE4C
SCHEMBL19509816 0.83 PDE4A (0.47) PDE4APDE4DP2RY12PDE4BPDE4C
SCHEMBL19509705 0.83 PDE4A (0.47) PDE4APDE4DP2RY12PDE4BPDE4C
SCHEMBL10459187 0.83 PDE4A (0.47) PDE4APDE4DP2RY12PDE4BPDE4C
SCHEMBL29772235 0.83 PDE4A (0.47) PDE4APDE4DP2RY12PDE4BPDE4C
SCHEMBL22984018 0.83 PDE4A (0.47) PDE4APDE4DP2RY12PDE4BPDE4C

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-4013428-A1 MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF Ionis Pharmaceuticals, Inc. (US) 2022-06-22 — — EP disclosed
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