SCHEMBL21281357

SCHEMBL21281357

O=C1NC(=O)C(O)(O)C(O)(O)C1N1Cc2c(NC(O)(O)c3ccc(CN4CCOCC4)cc3F)cccc2C1=O

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 10/20 0.39
▸ IKZF3 Q9UKT9 10/20 0.39
▸ TNF P01375 5/20 0.39
▸ DDB1 Q16531 5/20 0.39
▸ IL1B P01584 3/20 0.39
▸ IKZF1 Q13422 1/20 0.39
▸ CDK5 Q00535 1/20 0.35
▸ DYRK1A Q13627 1/20 0.35
▸ CDK5R1 Q15078 1/20 0.35
▸ DRD2 P14416 1/20 0.33
▸ ADRA1D P25100 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ ADRA1B P35368 1/20 0.33
▸ BDKRB1 P46663 1/20 0.33
▸ WDR5 P61964 3/20 0.32

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
SCHEMBL21924058 0.88 CRBN (0.43) CRBNIKZF3TNFDDB1IL1B
SCHEMBL23470056 0.86 CRBN (0.46) CRBNIKZF3TNFDDB1IL1B
SCHEMBL21281565 0.83 CRBN (0.59) CRBNIKZF3TNFDDB1IL1B
SCHEMBL21281543 0.83 BDKRB1 (0.34) CRBNIKZF3TNFDDB1IL1B
SCHEMBL20459014 0.82 CRBN (0.47) CRBNIKZF3TNFDDB1IL1B
SCHEMBL21924060 0.80 CRBN (0.46) CRBNIKZF3TNFDDB1IL1B
SCHEMBL21281545 0.80 CRBN (0.41) CRBNIKZF3TNFDDB1IL1B
SCHEMBL21281542 0.80 CRBN (0.54) CRBNIKZF3TNFDDB1IL1B
SCHEMBL19310115 0.79 WDR5 (0.32) CRBNIKZF3TNFDDB1IL1B
SCHEMBL19309958 0.79 CRBN (0.43) CRBNIKZF3TNFDDB1IL1B

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
EP-3527210-A1 COMPOSITION, APPLICATION THEREOF AND TREATMENT METHOD Kangpu Biopharmaceuticals, Ltd. (CN) 2019-08-21 — — EP disclosed
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