SCHEMBL25934617

SCHEMBL25934617

CC(C)(C)OC(=O)N1CCC(N2CCc3cc(B4OC(C)(C)C(C)(C)O4)ccc3C2)C(F)(F)C1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ USP30 Q70CQ3 1/20 0.44
▸ ESR2 Q92731 1/20 0.42
▸ DDB1 Q16531 1/20 0.38
▸ CRBN Q96SW2 1/20 0.38
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ NR1H2 P55055 1/20 0.37
▸ ROCK1 Q13464 1/20 0.37
▸ BACE1 P56817 1/20 0.35
▸ BACE2 Q9Y5Z0 1/20 0.35
▸ HRH3 Q9Y5N1 1/20 0.35
▸ GPR119 Q8TDV5 8/20 0.35
▸ PRMT5 O14744 3/20 0.34
▸ WDR77 Q9BQA1 3/20 0.34
▸ NAMPT P43490 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
SCHEMBL25934616 0.83 ESR2 (0.47) USP30ESR2DDB1CRBNNPC1
SCHEMBL30014804 0.83 ESR2 (0.47) USP30ESR2DDB1CRBNNPC1
SCHEMBL29676899 0.81 ESR2 (0.62) USP30ESR2DDB1CRBNNPC1
SCHEMBL587184 0.81 ESR2 (0.62) USP30ESR2DDB1CRBNNPC1
SCHEMBL27241645 0.79 USP30 (0.41) USP30HRH3GPR119
SCHEMBL2118099 0.79 ESR2 (0.52) USP30ESR2DDB1CRBNNPC1
SCHEMBL2515678 0.78 NR1H2 (0.61) USP30ESR2DDB1CRBNNPC1
SCHEMBL29964782 0.78 NR1H2 (0.61) USP30ESR2DDB1CRBNNPC1
SCHEMBL2589826 0.77 ROCK1 (0.48) USP30ESR2DDB1CRBNNR1H2
SCHEMBL27459527 0.77 USP30 (0.48) USP30DDB1CRBNNR1H2BACE1

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-2023109892-A1 COMPOUND FOR INHIBITING OR DEGRADING BRD9, AND COMPOSITION AND PHARMACEUTICAL USE THEREOF 海思科医药集团股份有限公司 2023-06-22 — — WO disclosed
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