SCHEMBL22984000

SCHEMBL22984000

CC(C)CNc1nc2c(ncn2[C@H]2C[C@H]3O[Si](C(C)C)(C(C)C)O[Si](C(C)C)(C(C)C)OC[C@@H]3O2)c(=O)[nH]1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 1/20 0.40
▸ POLA1 P09884 1/20 0.38
▸ TAS1R3 Q7RTX0 1/20 0.34
▸ TAS1R1 Q7RTX1 1/20 0.34
▸ STING1 Q86WV6 12/20 0.34
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL25504661 1.00 KDM4E (0.40) KDM4EPOLA1TAS1R3TAS1R1STING1
SCHEMBL8620596 0.85 STING1 (0.46) STING1
SCHEMBL12729604 0.85 STING1 (0.46) STING1
SCHEMBL25504663 0.84 STING1 (0.44) TAS1R3TAS1R1STING1ALDH1A1
SCHEMBL22984011 0.84 STING1 (0.44) TAS1R3TAS1R1STING1ALDH1A1
SCHEMBL12621476 0.84 STING1 (0.44) TAS1R3TAS1R1STING1ALDH1A1
SCHEMBL19491649 0.84 STING1 (0.44) TAS1R3TAS1R1STING1ALDH1A1
SCHEMBL6896069 0.83 KDM4E (0.36) KDM4EPOLA1TAS1R3TAS1R1STING1
SCHEMBL12621477 0.80 KDM4E (0.35) KDM4EPOLA1TAS1R3TAS1R1STING1
SCHEMBL17037317 0.80 STING1 (0.49) STING1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230159922-A1 MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF IONIS PHARMACEUTICALS, INC. (US) 2023-05-25 — — US disclosed
US-20230159922-A1 MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF IONIS PHARMACEUTICALS, INC. (US) 2023-05-25 — — US disclosed
EP-4013428-A1 MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF Ionis Pharmaceuticals, Inc. (US) 2022-06-22 — — EP disclosed
WO-2021030763-A1 MODIFIED OLIGOMERIC COMPOUNDS AND USES THEREOF IONIS PHARMACEUTICALS, INC. (US) 2021-02-18 — — WO disclosed
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