SCHEMBL29923644

SCHEMBL29923644

O=C1CCC(N2CCc3ccccc3C2)C(=O)N1

nearest known ligand 0.83

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 15/20 0.83
DDB1 Q16531 7/20 0.55
IKZF3 Q9UKT9 2/20 0.54
ALDH1A1 P00352 1/20 0.54
CHRM2 P08172 1/20 0.54
OPRM1 P35372 1/20 0.54
CYP1A2 P05177 1/20 0.54
TSHR P16473 1/20 0.54
TDP1 Q9NUW8 1/20 0.54
SLC18A3 Q16572 1/20 0.47

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
SCHEMBL19359391 1.00 CRBN (0.83) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL6180704 0.91 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29943635 0.91 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL1499656 0.91 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL6178113 0.91 CRBN (1.00) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL29923307 0.88 CRBN (0.63) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL19359233 0.88 CRBN (0.63) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL25834117 0.86 CRBN (0.61) CRBNDDB1IKZF3ALDH1A1CHRM2
SCHEMBL19359468 0.82 CRBN (0.60) CRBNDDB1
SCHEMBL19370693 0.82 CRBN (0.57) CRBNDDB1IKZF3ALDH1A1CHRM2

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-109153644-B Small molecules against CEREBLON to enhance effector T cell function H·李·莫菲特癌症中心研究有限公司 2022-10-21 CN disclosed