SCHEMBL29197004

SCHEMBL29197004

CC(=O)OC(C)(C)C.O=C(O)CN1CCC(c2ccc(C3CCC(=O)NC3=O)cc2F)CC1

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 12/20 0.48
▸ DDB1 Q16531 11/20 0.48
▸ POLB P06746 1/20 0.37
▸ ADRA1D P25100 3/20 0.37
▸ ADRA1A P35348 3/20 0.37
▸ ADRA1B P35368 3/20 0.37
▸ ADRA2A P08913 2/20 0.37
▸ ADRA2B P18089 2/20 0.37
▸ ADRA2C P18825 2/20 0.37
▸ HRH1 P35367 2/20 0.37
▸ IKZF2 Q9UKS7 3/20 0.36
▸ IKZF1 Q13422 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
SCHEMBL30120115 0.90 CRBN (0.43) CRBNDDB1POLBADRA1DADRA1A
SCHEMBL24125788 0.90 CRBN (0.43) CRBNDDB1POLBADRA1DADRA1A
SCHEMBL29877207 0.90 CRBN (0.51) CRBNDDB1POLBADRA1DADRA1A
SCHEMBL24125789 0.90 CRBN (0.51) CRBNDDB1POLBADRA1DADRA1A
Hydrochloric Acid SCHEMBL29197710 0.89 CRBN (0.42) CRBNDDB1POLBADRA1DADRA1A
Trifluoroacetic Acid SCHEMBL29094552 0.88 IKZF2 (0.45) CRBNDDB1POLBADRA1DADRA1A
SCHEMBL24881395 0.86 CRBN (0.42) CRBNDDB1POLBADRA1DADRA1A
SCHEMBL24881088 0.83 DDB1 (0.63) CRBNDDB1POLB
SCHEMBL29877042 0.83 DDB1 (0.63) CRBNDDB1POLB
SCHEMBL29094549 0.80 CRBN (0.40) CRBNDDB1POLBADRA1DADRA1A

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
CN-117940133-A Therapeutic agents for degradation of mutant BRAF C4医药公司 2024-04-26 — — CN disclosed
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