SCHEMBL25036546

SCHEMBL25036546

Cn1c(=O)n(C2CCC(=O)NC2=O)c2ccc(-c3cccc(CC(=O)O)c3)cc21

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 15/20 0.58
▸ DDB1 Q16531 14/20 0.58
▸ GRIN2D O15399 1/20 0.43
▸ GRIN3B O60391 1/20 0.43
▸ GRIN1 Q05586 1/20 0.43
▸ GRIN2A Q12879 1/20 0.43
▸ GRIN2B Q13224 1/20 0.43
▸ GRIN2C Q14957 1/20 0.43
▸ GRIN3A Q8TCU5 1/20 0.43
▸ NR1H2 P55055 1/20 0.37
▸ NR1H3 Q13133 1/20 0.37
▸ RXRA P19793 1/20 0.37
▸ RXRB P28702 1/20 0.37
▸ PTGS2 P35354 1/20 0.36
▸ PPARG P37231 1/20 0.36

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
SCHEMBL30273824 1.00 CRBN (0.58) CRBNDDB1GRIN2DGRIN3BGRIN1
SCHEMBL23541139 0.91 DDB1 (0.64) CRBNDDB1NR1H2NR1H3RXRA
SCHEMBL23842108 0.89 DDB1 (0.72) CRBNDDB1
SCHEMBL30273602 0.88 DDB1 (0.53) CRBNDDB1
SCHEMBL25036606 0.86 CRBN (0.58) CRBNDDB1
SCHEMBL31397004 0.86 CRBN (0.58) CRBNDDB1RXRARXRB
SCHEMBL25036702 0.85 CRBN (0.57) CRBNDDB1
SCHEMBL23540585 0.84 CRBN (0.62) CRBNDDB1RXRARXRB
SCHEMBL24818103 0.83 CRBN (0.70) CRBNDDB1
SCHEMBL23541177 0.83 DDB1 (0.54) CRBNDDB1

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-2023019166-A1 PROTEIN TYROSINE PHOSPHATASE TARGETING LIGANDS CALICO LIFE SCIENCES LLC (US) 2023-02-16 — — WO disclosed
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