SCHEMBL29637892

SCHEMBL29637892

COc1ccc(C(O[C@H]2C[C@H](n3cnc4c(NC(=O)c5ccccc5)ncnc43)O[C@@H]2CO)(c2ccccc2)c2ccc(OC)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 2/20 0.45
▸ PRKAG1 P54619 1/20 0.42
▸ PRKAA1 Q13131 1/20 0.42
▸ PRKAB1 Q9Y478 1/20 0.42
▸ POLB P06746 1/20 0.42

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
SCHEMBL3827645 1.00 ADORA1 (0.45) ADORA1PRKAG1PRKAA1PRKAB1POLB
SCHEMBL3827648 1.00 ADORA1 (0.45) ADORA1PRKAG1PRKAA1PRKAB1POLB
SCHEMBL3822659 0.93 TYMP (0.47) ADORA1
SCHEMBL3821904 0.90 TYMP (0.39) ADORA1
SCHEMBL3821907 0.90 TYMP (0.39) ADORA1
SCHEMBL24513540 0.88 P2RY12 (0.42) —
SCHEMBL29637929 0.88 P2RY12 (0.42) —
SCHEMBL31629565 0.87 POLB (0.49) ADORA1POLB
SCHEMBL21577261 0.86 TYMP (0.46) POLB
SCHEMBL3824084 0.85 TYMP (0.58) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4259798-A1 POLY-MORPHOLINO OLIGONUCLEOTIDE GAPMERS Eisai R&D Management Co., Ltd. (JP) 2023-10-18 — — EP disclosed
WO-2022125984-A1 TAU-TARGETING OLIGONUCLEOTIDE GAPMERS EISAI R&D MANAGEMENT CO., LTD. (JP) 2022-06-16 — — WO disclosed
WO-2022125987-A1 POLY-MORPHOLINO OLIGONUCLEOTIDE GAPMERS EISAI R&D MANAGEMENT CO., LTD. (JP) 2022-06-16 — — WO disclosed
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