SCHEMBL30851424

SCHEMBL30851424

O=C1CC[C@H](c2cccnc2)C(=O)N1

nearest known ligand 0.67

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ CRBN Q96SW2 12/20 0.67
▸ DDB1 Q16531 11/20 0.67
▸ CHRNB2 P17787 1/20 0.47
▸ CHRNA4 P43681 1/20 0.47
▸ POLB P06746 1/20 0.47
▸ KDM4E B2RXH2 2/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ TSHR P16473 1/20 0.46
▸ THPO P40225 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ MAPK1 P28482 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ MAPT P10636 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45

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
SCHEMBL9786755 1.00 CRBN (0.67) CRBNDDB1CHRNB2CHRNA4POLB
SCHEMBL31109516 1.00 CRBN (0.67) CRBNDDB1CHRNB2CHRNA4POLB
SCHEMBL26746596 0.86 DDB1 (0.49) CRBNDDB1CHRNB2CHRNA4POLB
SCHEMBL19586225 0.80 CRBN (1.00) CRBNDDB1POLB
SCHEMBL31704153 0.80 CRBN (1.00) CRBNDDB1POLB
SCHEMBL2107934 0.80 CRBN (1.00) CRBNDDB1POLB
SCHEMBL31704110 0.80 CRBN (1.00) CRBNDDB1POLB
SCHEMBL31699350 0.79 CHRNB2 (0.56) CHRNB2CHRNA4POLBKDM4ECYP3A4
SCHEMBL24832965 0.77 CRBN (0.60) CRBNDDB1POLB
SCHEMBL13035251 0.76 CHRNB2 (0.56) CRBNDDB1CHRNB2CHRNA4POLB

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-117813307-A Difunctional degradants of interleukin-1 receptor related kinase and therapeutic uses thereof 新锐思生物制药股份有限公司 2024-04-02 — — CN disclosed
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