Sugi Predict

Sugi Predict / Compounds / SCHEMBL21281376

SCHEMBL21281376

SCHEMBL21281376

BC(B)(Nc1cccc2c1C(O)(O)N([C@H]1CCC(=O)NC1=O)C2=O)c1ccc(C(O)(O)N2C(B)(O)C(O)(O)OC(B)(O)C2(O)O)cc1F

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 15/20 0.35
▸ DDB1 Q16531 11/20 0.35
▸ HDAC1 Q13547 2/20 0.33
▸ HDAC2 Q92769 2/20 0.33
▸ IKZF3 Q9UKT9 3/20 0.31
▸ IKZF1 Q13422 2/20 0.31
▸ CSNK1A1 P48729 1/20 0.31
▸ TNF P01375 1/20 0.31
▸ IL1B P01584 1/20 0.31
▸ TBXA2R P21731 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ CHRM2 P08172 1/20 0.30
▸ OPRM1 P35372 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL23939049 0.94 CRBN (0.35) CRBNDDB1HDAC1HDAC2IKZF3
SCHEMBL21281330 0.77 CRBN (0.36) CRBNDDB1HDAC1HDAC2IKZF3
SCHEMBL21927155 0.76 DDB1 (0.32) CRBNDDB1HDAC1HDAC2
SCHEMBL23939074 0.72 — —
SCHEMBL21925688 0.69 — —
SCHEMBL21281569 0.66 CRBN (0.37) CRBNDDB1IKZF3IKZF1CSNK1A1
SCHEMBL23938897 0.66 CRBN (0.35) CRBNDDB1IKZF3IKZF1CSNK1A1
SCHEMBL23938950 0.66 — —
SCHEMBL21281364 0.64 — —
SCHEMBL21281534 0.63 — —

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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