SCHEMBL24675514

SCHEMBL24675514

COC(=O)CCCCCOCCOCCOCCCCCCOc1ccc(F)c(CNC(=O)OC(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 5/20 0.41
▸ CA1 P00915 5/20 0.41
▸ CA2 P00918 5/20 0.41
▸ CA9 Q16790 5/20 0.41
▸ PDE3B Q13370 4/20 0.39
▸ PDE3A Q14432 4/20 0.39
▸ P2RY12 Q9H244 4/20 0.39
▸ PDE2A O00408 2/20 0.39
▸ PDK2 Q15119 1/20 0.38
▸ CNR2 P34972 2/20 0.36
▸ BCHE P06276 1/20 0.36
▸ HDAC8 Q9BY41 1/20 0.35

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
SCHEMBL29822802 1.00 CA12 (0.41) CA12CA1CA2CA9PDE3B
SCHEMBL24675640 0.89 CA12 (0.40) CA12CA1CA2CA9PDE3B
SCHEMBL29823274 0.89 CA12 (0.40) CA12CA1CA2CA9PDE3B
SCHEMBL30490969 0.87 CA12 (0.42) CA12CA1CA2CA9PDK2
SCHEMBL24675738 0.87 CA12 (0.42) CA12CA1CA2CA9PDK2
SCHEMBL25289842 0.82 GLS (0.46) CA12CA1CA2CA9CNR2
SCHEMBL30490889 0.82 GLS (0.46) CA12CA1CA2CA9CNR2
SCHEMBL24675148 0.81 PDE3B (0.44) PDE3BPDE3AP2RY12PDE2ACNR2
SCHEMBL24675802 0.81 PDE3B (0.38) CA12CA1CA2CA9PDE3B
SCHEMBL24675790 0.81 PDE3B (0.38) CA12CA1CA2CA9PDE3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023129564-A9 DEGRADERS OF GRK2 AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2024-02-08 — — WO disclosed
WO-2022159688-A9 DEGRADERS OF GRK2 AND USES THEREOF SONATA THERAPEUTICS, INC. (US) 2023-09-21 — — WO disclosed
WO-2023129564-A1 DEGRADERS OF GRK2 AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2023-07-06 — — WO disclosed
WO-2023129564-A1 DEGRADERS OF GRK2 AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2023-07-06 — — WO disclosed
WO-2022159688-A1 DEGRADERS OF GRK2 AND USES THEREOF CYGNAL THERAPEUTICS, INC. (US) 2022-07-28 — — WO disclosed
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